Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T74166 | Target Info | |||
| Target Name | Neuronal acetylcholine receptor alpha-3/beta-4 (CHRNA3/B4) | ||||
| Synonyms |
Neuronal acetylcholine receptor
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| Target Type | Successful Target | ||||
| Gene Name | CHRNA3-CHRNB4 | ||||
| Biochemical Class | Neurotransmitter receptor | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 113 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Nicotine
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|
Approved | Compound Info | ||
| Synonyms |
Habitrol; Micotine; NCT; NICOTINE AND SALTS; Nicoderm Patch; Nicotina [Italian]; Nicotine Patch; Nicotine [USAN]; Nicotine replacement patch; Nicotine solution; Nictoine patch; Nikotin [German]; Nikotyna [Polish]; Transdermal Nicotine; Nicotine [UN1654] [Poison]; ENT 3,424; Habitrol (TN); Nicorette (TN); Nicotine (USP); Nicotine (compounds related to); Nicotine [BSI:ISO]; L(-)-nicotine; Beta-Pyridyl-alpha-N-methyl pyrrolidine; (-)-Nicotine solution; (2S) 3-(1-Methyl-pyrrolidin-2-yl)-pyridine; (S)-(-)-NICOTINE, 3-[(2S)-1-METHYL-2-PYRROLIDINYL] PYRIDINE; (S)-(-)-Nicotine; (S)-3-(1-methylpyrrolidin-2-yl)pyridine; (S)-3-(N-methylpyrrolidin-2-yl)pyridine; (S)-Nicotine; 3-(2-(N-methylpyrrolidinyl))pyridine; 3-(N-Methylpyrollidino)pyridine; 3-(N-Methylpyrrolidino)pyridine; 3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
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| Activity |
EC50 = 51000 nM
|
[1] | |||
| Compound Name |
Acetylcholine
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Approved | Compound Info | ||
| Synonyms |
acetylcholine; Choline acetate; O-Acetylcholine; Acetyl choline ion; Acetylcholinum; 51-84-3; (2-Acetoxyethyl)trimethylammonium; Acetyl choline cation; Choline acetate (ester); 2-(Acetyloxy)-N,N,N-trimethylethanaminium; Ach; Azetylcholin; ethanaminium, 2-(acetyloxy)-N,N,N-trimethyl-; UNII-N9YNS0M02X; BRN 1764436; CHEBI:15355; Bromoacetylcholine; EINECS 200-128-9; CHEMBL667; N9YNS0M02X; [2-(acetyloxy)ethyl]trimethylazanium; Ethanaminium, 2-(acetyloxy)-N,N,N-trimethyl- (9CI); 2-acetyloxyethyl-trimethylazanium; [3H]acetylcholine; Miochol; Miochol-e
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| Activity |
EC50 = 127000 nM
|
[2] | |||
| Compound Name |
AZD-1446
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Phase 2 | Compound Info | ||
| Synonyms |
TC-6683; Alpha-4 beta-2 neuronal nicotinic receptor modulator (oral, cognitive disorder), Targacept/AstraZeneca
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| Activity |
EC50 = 70000 nM
|
[3] | |||
| Compound Name |
TC-2216
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Phase 1 | Compound Info | ||
| Synonyms |
NNR Therapeutics; TC-5685; Nicotinic ACh modulators (schizophrenia), Targacept; Alpha-4 beta-2 neuronal nicotinic receptor (schizophrenia, depression), Targacept; Oral alpha-4/beta-2 neuronal nicotinic receptor stimulator (shizophrenia/depression), Targacept
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| Activity |
EC50 = 55000 nM
|
[4] | |||
| Compound Name |
ABT-418
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Discontinued in Phase 2 | Compound Info | ||
| Synonyms |
Abt-418; Abt 418; 147402-53-7; 3-methyl-5-(1-methyl-2-pyrrolidinyl)isoxazole; CHEMBL274525; (S)-3-Methyl-5-(1-methyl-2-pyrrolidinyl)isoxazole; (S)-3-methyl-5-(1-methylpyrrolidin-2-yl)isoxazole; C9H14N2O; Isoxazole, 3-methyl-5-((2S)-1-methyl-2-pyrrolidinyl)-; Isoxazole, 3-methyl-5-(1-methyl-2-pyrrolidinyl)-, (S)-; Isoxazole, 3-methyl-5-[(2S)-1-methyl-2-pyrrolidinyl]-; 3-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]-1,2-oxazole; AC1L3OPH; SCHEMBL194161; DTXSID10163711; ILLGYRJAYAAAEW-QMMMGPOBSA-N; ZINC3786099; BDBM50035398
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| Activity |
EC50 = 64000 nM
|
[5] | |||
| Compound Name |
PNU-282987
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Terminated | Compound Info | ||
| Synonyms |
Benzamide, N-(3R)-1-azabicyclo[222]oct-3-yl-4-chloro-; PNU282987; 123464-89-1; 711085-63-1; PNU 282987; UNII-27M563MU5U; N-(3R)-1-Azabicyclo[222]oct-3-yl-4-chlorobenzamide; CHEMBL177611; 27M563MU5U; Benzamide, N-(3R)-1-azabicyclo(222)oct-3-yl-4-chloro-; CHEMBL554984; PNU-282,987; PNU-282987 free base; SCHEMBL677422; PNU282987HCl; GTPL3988; CHEBI:92508; CTK2H4027; MolPort-023-219-197; MolPort-003-983-664; HMS3268J18; ZINC3990028; BDBM50161764; BDBM50161753; ABP000998; AKOS016339643; AKOS024457037; KS-1399; API0008100; N-((3R)-1-Azabicyclo(222)oct-3-yl)-4-chlorobenzamide hydrochloride; ISIS 25302
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| Activity |
Ki ~ 60000 nM
|
[6] | |||
| Compound Name |
PH-709829
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Investigative | Compound Info | ||
| Synonyms |
PTGWFYYEAUFEAS-ZYHUDNBSSA-N; CHEMBL403858; PHA-709829; SCHEMBL844377; GTPL3997; BDBM50377050
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| Activity |
IC50 ~ 100000 nM
|
[7] | |||
| Compound Name |
(4-Bromofuran-2-yl)-(3,7-diazabicyclo[3.3.1]nonan-3-yl)methanone
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179547; SCHEMBL10037529; BDBM50397929
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| Activity |
EC50 = 50000 nM
|
[8] | |||
| Compound Name |
6-[5-[(Azetidine-2alpha-yl)methoxy]-6-methyl-3-pyridinyl]-5-hexyne-1-ol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2323570; SCHEMBL14952671; BDBM50428081; 6-[5-[[(2S)-azetidin-2-yl]methoxy]-6-methylpyridin-3-yl]hex-5-yn-1-ol
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| Activity |
IC50 = 50000 nM
|
[9] | |||
| Compound Name |
O-3-(Dimethylamino)butyl dimethylcarbamothioate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL468903; BDBM50254542
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| Activity |
EC50 = 50118.72 nM
|
[10] | |||
| Compound Name |
3-(Dimethylamino)butyl methyl(phenyl)carbamate
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL479623; BDBM50254605
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| Activity |
EC50 = 50118.72 nM
|
[10] | |||
| Compound Name |
3-(Dimethylamino)butyl ethylcarbamate
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL451633; BDBM50254484
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| Activity |
EC50 = 50118.72 nM
|
[10] | |||
| Compound Name |
2,3,3a,4,6,6a-Hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl(pyridin-2-yl)methanone
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179518; BDBM50397911; AKOS015555214
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| Activity |
EC50 = 51000 nM
|
[8] | |||
| Compound Name |
Altinicline
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Investigative | Compound Info | ||
| Synonyms |
UNII-RJ9V9V09VM; RJ9V9V09VM; SIB-1508Y; CHEMBL111659; Pyridine, 3-ethynyl-5-((2S)-1-methyl-2-pyrrolidinyl)-; Pyridine, 3-ethynyl-5-[(2S)-1-methyl-2-pyrrolidinyl]-; Altinicline [INN]; (-)-5-Ethynylnicotine; Sib 1508y; 3-ethynyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine; SCHEMBL1155703; Pyridine, 3-ethynyl-5-(1-methyl-2-pyrrolidinyl)-, (S)-; PYRIDINE,3-ETHYNYL-5-[(2S)-1-METHYL-2-PYRROLIDINYL]-; ZINC3826943; BDBM50052593; AKOS006238794; (s)-3-ethynyl-5-(1-methylpyrrolidin-2-yl)pyridine; J-011431; Q4736710; 3-Ethynyl-5-((S)-1-methyl-azetidin-2-yl)-pyridine; 3-Ethynyl-5-((S)-1-methyl-pyrrolidin-2-yl)-pyridine
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| Activity |
EC50 = 52000 nM
|
[1] | |||
| Compound Name |
3,7-Diazabicyclo[3.3.1]nonan-3-yl(pyridin-4-yl)methanone
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179524; SCHEMBL584474; BDBM50397895
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| Activity |
EC50 = 54000 nM
|
[8] | |||
| Compound Name |
(4-Chlorofuran-2-yl)-(3,7-diazabicyclo[3.3.1]nonan-3-yl)methanone
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179544; SCHEMBL10037528; BDBM50397932
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| Activity |
EC50 = 54000 nM
|
[8] | |||
| Compound Name |
2,3,3a,4,6,6a-Hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl-(4-chlorofuran-2-yl)methanone
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179530; SCHEMBL10037485; BDBM50397889
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|
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| Activity |
EC50 = 56000 nM
|
[8] | |||
| Compound Name |
3-(Dimethylamino)butyl carbamate
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL449334; BDBM50254483
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| Activity |
EC50 = 57000 nM
|
[10] | |||
| Compound Name |
2,3,3a,4,6,6a-Hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl-(5-methylfuran-2-yl)methanone
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179538; SCHEMBL584062; BDBM50397938; AKOS015556989
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| Activity |
EC50 = 57000 nM
|
[8] | |||
| Compound Name |
Benzamide, N-(3R)-1-azabicyclo(2.2.2)oct-3-yl-4-chloro-, hydrochloride (1:1)
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Investigative | Compound Info | ||
| Synonyms |
PNU-282987; PNU282987 HCl; UNII-810P1694K2; (R)-4-Chloro-N-(quinuclidin-3-yl)benzamide hydrochloride; 123464-89-1 (HCl salt); 810P1694K2; PNU-282,987; N-((3R)-1-Azabicyclo(2.2.2)oct-3-yl)-4-chlorobenzamide hydrochloride; N-(3R)-1-Azabicyclo[2.2.2]oct-3-yl-4-chloro-benzamide monohydrochloride; CHEMBL554984; Benzamide, N-(3R)-1-azabicyclo[2.2.2]oct-3-yl-4-chloro-, hydrochloride (1:1); N-[(3R)-1-azabicyclo[2.2.2]oct-3-yl]-4-chlorobenzamide hydrochloride; Benzamide, N-(3R)-1-azabicyclo(2.2.2)oct-3-yl-4-chloro-, monohydrochloride; C14H17ClN2O.ClH; PNU-282,987 hydrate; PNU 282987 hydrochloride; SCHEMBL1118980; KS-00001CZJ; AOB5089; DTXSID801017103; EX-A1066; Tox21_500939; 2929AH; HY-12560A; s5930; CCG-222243; CS-3810; LP00939; Benzamide, N-1-azabicyclo(2.2.2)oct-3-yl-4-chloro-, monohydrochloride, (R)-; NCGC00261624-01; (R)-4-chloro-N-(quinuclidin-3-yl)benzamide HCl; J-004947; Q7119896; (R)-4-Chloro-N-(quinuclidin-3-yl)benzamide hydrochloride (1:1)
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| Activity |
IC50 ~ 60000 nM
|
[11] | |||
| Compound Name |
5-(2,3,3a,4,6,6a-Hexahydro-1H-pyrrolo[3,4-c]pyrrole-5-carbonyl)furan-2-carbonitrile
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179535; SCHEMBL10068515; BDBM50397941
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| Activity |
EC50 = 61000 nM
|
[8] | |||
| Compound Name |
4-Allyloxy-N-pyridin-2-yl-benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407124; CBMicro_017672; ChemDiv2_000481; Cambridge id 6114880; Oprea1_739442; Oprea1_844260; CTK4I6146; DTXSID70367470; HMS1370F19; ZINC2951151; BDBM50437517; CCG-14075; STK386603; AKOS000549399; MCULE-3377091198; 4-(Allyloxy)-N-(pyridin-2-yl)benzamide; BIM-0017870.P001; EU-0040482; 4-(prop-2-en-1-yloxy)-N-(pyridin-2-yl)benzamide; BENZAMIDE, 4-(2-PROPENYLOXY)-N-2-PYRIDINYL-
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| Activity |
IC50 = 61400 nM
|
[12] | |||
| Compound Name |
[1-(3-Phenylpropyl)piperidin-3-yl]methyl 2-naphthalen-1-ylbenzoate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1950519; BDBM50419837
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| Activity |
IC50 = 63095.73 nM
|
[13] | |||
| Compound Name |
(1R,6S)-8-(5-Methoxy-pyridin-3-yl)-3,8-diaza-bicyclo[4.2.0]octane
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL220351; SCHEMBL650879; BDBM50201066; (1S,6R)-7-(5-methoxypyridin-3-yl)-4,7-diazabicyclo[4.2.0]octane
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| Activity |
EC50 = 63095.73 nM
|
[14] | |||
| Compound Name |
N-(6-Bromopyridin-2-yl)-4-prop-2-enoxybenzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407125; BDBM50437516
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| Activity |
IC50 = 65500 nM
|
[12] | |||
| Compound Name |
CID 24945129
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179956; SCHEMBL584647; BDBM50397915; 2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl(1,2-oxazol-5-yl)methanone
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| Activity |
EC50 = 66000 nM
|
[8] | |||
| Compound Name |
Pyridine, 3-ethynyl-5-[(2R)-1-methyl-2-pyrrolidinyl]-
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Investigative | Compound Info | ||
| Synonyms |
5-Ethynyl Nicotine; CHEMBL1788226; CTK8E6768; BDBM50369150; AKOS025394468; (R)-3-Ethynyl-5-(1-methylpyrrolidin-2-yl)pyridine; 3-ethynyl-5-[(2R)-1-methylpyrrolidin-2-yl]pyridine; 3-[(2R)-1-Methylpyrrolidin-2beta-yl]-5-ethynylpyridine
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| Activity |
EC50 = 68000 nM
|
[1] | |||
| Compound Name |
Furan-2-yl(hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)methanone
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179966; SCHEMBL584751; BDBM50397900; AKOS015555614; 2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl(furan-2-yl)methanone
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| Activity |
Ki = 72000 nM
|
[8] | |||
| Compound Name |
(1R,5S)-6-(5-Ethynylpyridin-3-yl)-3,6-diazabicyclo[3.2.0]heptane
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL239722; SCHEMBL652717; BDBM50224461; (1R,5S)-6-(5-ethynylpyridin-3-yl)-3,6-diazabicyclo[3.2.0]-heptane
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| Activity |
EC50 = 77624.71 nM
|
[15] | |||
| Compound Name |
N-[6-(Butylamino)pyridin-2-yl]-4-propoxybenzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407135; BDBM50437533
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| Activity |
IC50 = 77800 nM
|
[12] | |||
| Compound Name |
CID 24945124
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179560; SCHEMBL585356; BDBM50397916; 2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl(1,3-oxazol-2-yl)methanone
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| Activity |
EC50 = 79000 nM
|
[8] | |||
| Compound Name |
N-[(3R)-1-Azabicyclo[2.2.2]oct-3-yl]-1-benzofuran-6-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL379302; SCHEMBL5917835; BDBM50190783; N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-1-benzofuran-6-carboxamide
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| Activity |
IC50 = 81000 nM
|
[16] | |||
| Compound Name |
2alpha-[[[2-Methyl-5-(6-chloro-1-hexynyl)-3-pyridinyl]oxy]methyl]azetidine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2323572; SCHEMBL14952739; BDBM50428086; 3-[[(2S)-azetidin-2-yl]methoxy]-5-(6-chlorohex-1-ynyl)-2-methylpyridine
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| Activity |
Ki = 86000 nM
|
[9] | |||
| Compound Name |
5-(Dimethylamino)-N,N-dimethylhex-2-enamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL468697; BDBM50254541
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| Activity |
EC50 = 91000 nM
|
[10] | |||
| Compound Name |
2alpha-[[[2-Methyl-5-(1-hexynyl)-3-pyridinyl]oxy]methyl]pyrrolidine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2323568; SCHEMBL14952666; BDBM50428083; 5-hex-1-ynyl-2-methyl-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
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| Activity |
Ki = 94000 nM
|
[9] | |||
| Compound Name |
N-(4-Methoxyphenyl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)acetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1940801; BDBM50419616
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| Activity |
IC50 = 95000 nM
|
[17] | |||
| Compound Name |
3-(Dimethylamino)butyl propylcarbamate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL466399; BDBM50254485
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| Activity |
EC50 = 95000 nM
|
[10] | |||
| Compound Name |
N-(2-Fluorophenyl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]acetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1940791; BDBM50419605
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| Activity |
IC50 = 99800 nM
|
[17] | |||
| Compound Name |
2-[4-(4-Fluorophenyl)sulfonylpiperazin-1-yl]-N-(1H-pyrazol-5-yl)acetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1940787; BDBM50419617
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| Activity |
IC50 ~ 100000 nM
|
[17] | |||
| Compound Name |
(3R)-N-(6-Methylpyrimidin-4-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4075880; BDBM50232603
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| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
N-(1H-Pyrazol-5-yl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)acetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1940800; BDBM50419612
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| Activity |
IC50 ~ 100000 nM
|
[17] | |||
| Compound Name |
N-(6-Chloropyridin-2-yl)-4-propoxybenzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407131; BDBM50437510
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| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
(3S)-5-Chloro-3-[2-(furan-2-yl)-2-oxoethyl]-3-hydroxy-1-prop-2-enylindol-2-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2022554; ZINC5245296; BDBM50382408
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| Activity |
IC50 ~ 100000 nM
|
[19] | |||
| Compound Name |
2-(6-Chloropyridin-3-yl)-2,7-diazaspiro[4.4]nonane
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL504126; SCHEMBL1556835; CTK2A4891; DTXSID60624448; BDBM50257942; 2,7-Diazaspiro[4.4]nonane, 2-(6-chloro-3-pyridinyl)-
Click to Show/Hide
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| Activity |
EC50 ~ 100000 nM
|
[20] | |||
| Compound Name |
N-[6-(3-Fluoroanilino)pyridin-2-yl]-4-propoxybenzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407140; BDBM50437528
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| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
2-(2-Methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)xanthen-9-one
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
A 844606; CHEMBL1950171; A-844606; SCHEMBL1791588; BDBM50364857; AKOS024458180; NCGC00371020-01; CID 11461365; 2-(Hexahydro-5-methylpyrrolo[3,4-c]pyrrol-2(1H)-yl)-9H-xanthen-9-one
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[21] | |||
| Compound Name |
N-(6-Anilinopyridin-2-yl)-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407138; BDBM50437530
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
(1S,2R,4S)-N-(Isoquinolin-3-yl)-4'H-4-azaspiro[bicyclo[2.2.2]octane-2,5'-oxazol]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
BMS-902483; CHEMBL3918431; SCHEMBL559052; BDBM50206243; (3R)-N-isoquinolin-3-ylspiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine; (R)-N-(isoquinolin-3-yl)-4H-1'-azaspiro[oxazole-5,3'-bicyclo[2.2.2]octan]-2-amine
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-(5-Methylpyrazin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4063152; SCHEMBL10219760; BDBM50232607
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
4-[[2-[4-(2-Fluorophenyl)sulfonylpiperazin-1-yl]acetyl]amino]benzoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1940798; BDBM50419599
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[17] | |||
| Compound Name |
(3R)-N-(5-Methoxypyrazin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4101249; BDBM50232616
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-(6-Propan-2-ylpyrimidin-4-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4066807; BDBM50232617
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
N-(Naphthylmethyl)(2-phenylphenyl)carboxamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1950631; Oprea1_834842; BDBM50419810; ZINC20530435; AKOS003242515; MCULE-9887634355; ST45000391
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[13] | |||
| Compound Name |
3,7-Diazabicyclo[3.3.1]nonan-3-yl(phenyl)methanone
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2179522; SCHEMBL7094723; BDBM50397907
Click to Show/Hide
|
||||
| Activity |
Ki = 100000 nM
|
[8] | |||
| Compound Name |
N-[(3R)-1-Azabicyclo[2.2.2]oct-3-yl]-1-benzofuran-5-carboxamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL378471; N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-1-benzofuran-5-carboxamide; SCHEMBL5917904; CTK1D9854; DTXSID70433169; BDBM50190788; (R)-N-(Quinuclidin-3-yl)benzofuran-5-carboxamide; 5-Benzofurancarboxamide, N-(3R)-1-azabicyclo[2.2.2]oct-3-yl-
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[16] | |||
| Compound Name |
CID 52920236
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4102566; SCHEMBL558102; BDBM50232594; (3R)-N-(6-phenylpyrimidin-4-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(1R,5S)-N-Methyl-3-azabicyclo[3.3.1]nonane-7-carboxamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2409475; BDBM50437478
Click to Show/Hide
|
||||
| Activity |
EC50 = 100000 nM
|
[3] | |||
| Compound Name |
7-(6-Chloropyridin-3-yl)-1,7-diazaspiro[4.4]nonane
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL509239; SCHEMBL1556037; CTK2A4934; 7-(6-chloro-pyridin-3-yl)-1,7-diaza-spiro[4.4]nonane; DTXSID70471061; BDBM50257893; 1,7-Diazaspiro[4.4]nonane, 7-(6-chloro-3-pyridinyl)-
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[20] | |||
| Compound Name |
N-Pyrimidin-4-ylspiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4064914; BDBM50232596
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
2-(4-Morpholinyl)-5-[(2-thienylmethyl)amino]benzoic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1536503; MLS000039729; HMS2418B22; ZINC4038080; BDBM50382407; STK171747; AKOS001479565; CCG-122679; MCULE-2027546271; SMR000035988; AN-465/43266038; SR-01000301689; SR-01000301689-1; 2-morpholin-4-yl-5-[(thien-2-ylmethyl)amino]benzoic acid; 2-(morpholin-4-yl)-5-[(thiophen-2-ylmethyl)amino]benzoic acid
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[19] | |||
| Compound Name |
3-(Dimethylamino)-4-hydroxybutyl dimethylcarbamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL480798; BDBM50254600
Click to Show/Hide
|
||||
| Activity |
Ki = 100000 nM
|
[10] | |||
| Compound Name |
2-Pyridin-3-yl-2,7-diazaspiro[4.4]nonane
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL504595; SCHEMBL1556831; CTK2A4904; DTXSID20437495; BDBM50257943; 2-(pyridin-3-yl)-2,7-diazaspiro[4.4]nonane; 2,7-Diazaspiro[4.4]nonane, 2-(3-pyridinyl)-
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[20] | |||
| Compound Name |
(3R)-N-(4-Propan-2-ylpyrimidin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4095046; BDBM50232599
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
N-[6-(Pentylamino)pyridin-2-yl]-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407136; BDBM50437532
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
(R)-N-(5-Chloropyrazin-2-yl)-4H-1'-azaspiro[oxazole-5,3'-bicyclo[2.2.2]octan]-2-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4077222; SCHEMBL2700593; BDBM50232605; (3R)-N-(5-chloropyrazin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(R)-N-(6-Methoxypyrimidin-4-yl)-4H-1'-azaspiro[oxazole-5,3'-bicyclo[2.2.2]octan]-2-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4079623; SCHEMBL558275; BDBM50232601; (3R)-N-(6-methoxypyrimidin-4-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-(6-Chloropyrimidin-4-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4097654; BDBM50232602
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-Pyrimidin-5-ylspiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4092614; BDBM50232597
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-(5-Phenylpyrazin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4093500; BDBM50232604
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
N-[6-(4-Chloroanilino)pyridin-2-yl]-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2409791; BDBM50437526
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
2-[4-(2-Fluorophenyl)sulfonylpiperazin-1-yl]-N-(1H-pyrazol-5-yl)acetamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1940799; BDBM50419600
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[17] | |||
| Compound Name |
(3R)-N-(5-Methoxypyrimidin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4089244; BDBM50232610
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-(1,7-Naphthyridin-6-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4098850; BDBM50232612
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
N-((3-(2-Chlorophenyl)isoxazol-5-yl)methyl)-N-methylpiperidine-4-carboxamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL497990; BDBM50264882
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[22] | |||
| Compound Name |
Biphenyl-2-carboxylic acid 1-(3-phenyl-propyl)-piperidin-3-ylmethyl ester
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL124418; BDBM50149040
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[13] | |||
| Compound Name |
[1-(3-Phenylpropanoyl)piperidin-3-yl]methyl 2-phenylbenzoate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1950636; BDBM50419815
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[13] | |||
| Compound Name |
3,5,5-Trimethyl-2-(pyridin-3-yl)morpholin-2-ol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1173599; SCHEMBL2599164; BDBM50322509; 3,5,5-trimethyl-2-pyridin-3-ylmorpholin-2-ol; (+/-)3,5,5-Trimethyl-2-(pyridin-3-yl)morpholin-2-ol
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[23] | |||
| Compound Name |
N-(6-Chloropyridin-2-yl)-4-prop-2-enoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407126; BDBM50437515
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
(3R)-N-Pyrazin-2-ylspiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4102804; BDBM50232614
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-(5-Methylpyrimidin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4061082; BDBM50232613
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
CID 58088118
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3898922; SCHEMBL558574; BDBM50211215; (3R)-N-pyridin-2-ylspiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
3-(2-Chlorophenyl)-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)isoxazole
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL526090; BDBM50264883
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[22] | |||
| Compound Name |
(3R)-N-(4-Methylpyrimidin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4084852; BDBM50232598
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
3-(1,4-Diazabicyclo[3.2.2]nonane-4-yl)dibenzothiophene 5,5-dioxide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1950167; SCHEMBL1793916; BDBM50364856; 3-(1,4-diazabicyclo[3.2.2]nonan-4-yl)dibenzothiophene 5,5-dioxide; 4-(5,5-Dioxo-5H-5lambda6-dibenzothiophen-3-yl)-1,4-diazabicyclo[3.2.2]nonane
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[21] | |||
| Compound Name |
1,6-Diazaspiro[3.4]octane, 6-(3-pyridinyl)-
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL449142; 6-(pyridin-3-yl)-1,6-diazaspiro[3.4]octane; 7-pyridin-3-yl-1,7-diazaspiro[3.4]octane; SCHEMBL1556932; CTK2A4886; DTXSID90468074; BDBM50257892; 1,6-Diazaspiro[3.4]octane,6-(3-pyridinyl)-
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[20] | |||
| Compound Name |
(R)-N-(5-m-Tolylpyrimidin-2-yl)-4H-1'-azaspiro[oxazole-5,3'-bicyclo[2.2.2]octan]-2-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4071766; SCHEMBL2701293; BDBM50232608; (R)-N-(5-m-tolylpyrimidin-2-yl)-4H-1'-azaspiro [oxazole-5,3'-bicyclo[2.2.2]octan]-2-amine
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
1-[3-(Dimethylamino)propyl]-2-oxo-4-phenylquinoline-3-carbonitrile
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2332488; SCHEMBL11451156; BDBM50430241
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[24] | |||
| Compound Name |
N-[6-(Hexylamino)pyridin-2-yl]-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407137; BDBM50437531
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
(3R)-N-(4-Methoxypyrimidin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4074583; BDBM50232600
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-(6-Methylpyrazin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4083246; BDBM50232606
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-(4-Phenylpyrimidin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4098776; BDBM50232609
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
N-[6-(4-Fluoroanilino)pyridin-2-yl]-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407141; BDBM50437527
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
S-3-(Dimethylamino)butyl dimethylcarbamothioate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL480797; BDBM50254597
Click to Show/Hide
|
||||
| Activity |
Ki = 100000 nM
|
[10] | |||
| Compound Name |
CID 58088056
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4071859; SCHEMBL558264; BDBM50232611; (3R)-N-quinazolin-2-ylspiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
3-[[(2S)-Azetidin-2-yl]methoxy]-5-hex-1-ynyl-2-(trifluoromethyl)pyridine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2323573; SCHEMBL14952672; BDBM221301; US9303017, (S)-32
Click to Show/Hide
|
||||
| Activity |
Ki ~ 100000 nM
|
[9] | |||
| Compound Name |
N-[6-(4-Methoxyanilino)pyridin-2-yl]-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2409792; BDBM50437525
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
(R)-N-(Quinuclidin-3-yl)furo(2,3-C)pyridine-5-carboxamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
PHA-543613; PHA-543,613; UNII-R36R9KVD6Y; R36R9KVD6Y; CHEMBL214268; N-[(3R)-1-azabicyclo[2.2.2]oct-3-yl]furo[2,3-c]pyridine-5-carboxamide; PHA 543613 dihydrochloride; (R)-N-(quinuclidin-3-yl)furo[2,3-c]pyridine-5-carboxamide; N-((3R)-1-Azabicyclo(2.2.2)oct-3-yl)furo(2,3-C)pyridine-5-carboxamide; N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]furo[2,3-c]pyridine-5-carboxamide; PHA543613; DSSTox_CID_27284; DSSTox_RID_82238; DSSTox_GSID_47284; GTPL3998; SCHEMBL2596554; DTXSID6047284; Tox21_300448; BDBM50190786; ZINC34034921; AKOS005146334; NCGC00248050-01; NCGC00254368-01; PHA-00543613; J3.179.420J; PHA-543613, >=98% (HPLC); Furo(2,3-C)pyridine-5-carboxamide, N-(3R)-1-azabicyclo(2.2.2)oct-3-yl-; N-(1-Azabicyclo[2.2.2]oct-3(R)-yl)furo[2,3-c]pyridine-5-carboxamide
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[7] | |||
| Compound Name |
(3R)-N-(3-Methylpyrazin-2-yl)spiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4091037; BDBM50232615
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
(3R)-N-Pyrimidin-2-ylspiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4100355; BDBM50232595
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
N-(6-Bromopyridin-2-yl)-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407130; BDBM50437511
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
N-(6-Piperidin-1-ylpyridin-2-yl)-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2409794; BDBM50437523
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
3,5,5-Trimethyl-2-(pyridin-2-yl)morpholin-2-ol
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1173600; SCHEMBL2598219; BDBM50322508; 3,5,5-trimethyl-2-pyridin-2-ylmorpholin-2-ol; (+/-)3,5,5-Trimethyl-2-(pyridin-2-yl)morpholin-2-ol
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[23] | |||
| Compound Name |
Dendocarbin A
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
(1R,5aS,9aS,9bR)-1-hydroxy-6,6,9a-trimethyl-5,5a,7,8,9,9b-hexahydro-1H-benzo[e][2]benzofuran-3-one; CHEMBL512505; BDBM50465351; ZINC40894591; AKOS032961791
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[25] | |||
| Compound Name |
5'-Phenylspiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]pyridine]
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL189861; SCHEMBL373116; BDBM50170598; 5''-phenyl-3''H-4-azaspiro[bicyclo[2.2.2]octane-2,2''-furo[2,3-b]pyridine]; 5'-Phenylspiro[1-azabicyclo[2.2.2]octane-3,2'(3'H)-furo[2,3-b]pyridine]
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[26] | |||
| Compound Name |
N-Pyrazin-2-ylspiro[1-azabicyclo[2.2.2]octane-3,5'-4H-1,3-oxazole]-2'-amine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL4087500; BDBM50232593
Click to Show/Hide
|
||||
| Activity |
EC50 ~ 100000 nM
|
[18] | |||
| Compound Name |
N-[6-(2-Fluoroanilino)pyridin-2-yl]-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2407139; BDBM50437529
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
N-[6-(Benzylamino)pyridin-2-yl]-4-propoxybenzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2409793; BDBM50437524
Click to Show/Hide
|
||||
| Activity |
IC50 ~ 100000 nM
|
[12] | |||
| Compound Name |
2alpha-[[[2-Methyl-5-(6-fluoro-1-hexynyl)-3-pyridinyl]oxy]methyl]azetidine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2323571; SCHEMBL14952535; BDBM50428080; 3-[[(2S)-azetidin-2-yl]methoxy]-5-(6-fluorohex-1-ynyl)-2-methylpyridine
Click to Show/Hide
|
||||
| Activity |
Ki = 130000 nM
|
[9] | |||
| Compound Name |
2alpha-[[[2-Methyl-5-(cyclopropylethynyl)-3-pyridinyl]oxy]methyl]azetidine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2323569; SCHEMBL14941391; BDBM50428079; 3-[[(2S)-azetidin-2-yl]methoxy]-5-(2-cyclopropylethynyl)-2-methylpyridine
Click to Show/Hide
|
||||
| Activity |
Ki = 150000 nM
|
[9] | |||
| Compound Name |
5-(Dimethylamino)-N-methylhex-2-enamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL503940; BDBM50254540
Click to Show/Hide
|
||||
| Activity |
EC50 = 150000 nM
|
[10] | |||
| Compound Name |
3-(Dimethylamino)Butyl Methylcarbamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL466400; BDBM50254538
Click to Show/Hide
|
||||
| Activity |
EC50 = 158489.32 nM
|
[10] | |||
| Compound Name |
3-(Dimethylamino)butyl 2-hydroxyethyl(methyl)carbamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL479622; BDBM50254604
Click to Show/Hide
|
||||
| Activity |
EC50 = 158489.32 nM
|
[10] | |||
| Compound Name |
3-[[(2R)-Azetidin-2-yl]methoxy]-5-hex-1-ynyl-2-methylpyridine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2323565; SCHEMBL14952613; BDBM50428082
Click to Show/Hide
|
||||
| Activity |
Ki = 200000 nM
|
[9] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 20 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
5-Hex-1-ynyl-2-methyl-3-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2323567; SCHEMBL14952669; BDBM50428084
Click to Show/Hide
|
||||
| Activity |
Ki = 220000 nM
|
[9] | |||
| Compound Name |
2alpha-[[[2-Methyl-5-(1-hexynyl)-3-pyridinyl]oxy]methyl]azetidine
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2323566; SCHEMBL14952659; BDBM50428085; 3-[[(2S)-azetidin-2-yl]methoxy]-5-hex-1-ynyl-2-methylpyridine
Click to Show/Hide
|
||||
| Activity |
Ki = 230000 nM
|
[9] | |||
| Compound Name |
(1R,16R)-16-Methoxy-5-oxa-10-azatetracyclo[8.7.0.01,13.02,7]heptadeca-2(7),13-dien-4-one
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL335712; BDBM50061562; CCG-36452; ZINC53022008; (12R,13aR)-12-Methoxy-1,4,5,6,9,11,12,13-octahydro-8H-pyrano[4'',3'':3,4]pyrido[2,1-i]indol-2-one
Click to Show/Hide
|
||||
| Activity |
IC50 = 240000 nM
|
[26] | |||
| Compound Name |
5-(Dimethylamino)-N,N-dimethylhexanamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL445169; BDBM50254539
Click to Show/Hide
|
||||
| Activity |
Ki = 300000 nM
|
[10] | |||
| Compound Name |
3-(Dimethylamino)butyl 2-hydroxyethylcarbamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL501227; BDBM50254486
Click to Show/Hide
|
||||
| Activity |
EC50 = 300000 nM
|
[10] | |||
| Compound Name |
3-(Dimethylamino)butyl 3-methylazetidine-1-carboxylate;oxalic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1202079
Click to Show/Hide
|
||||
| Activity |
EC50 > 316227.77 nM
|
[27] | |||
| Compound Name |
[1-[3-(4-Phenyltriazol-1-yl)propyl]piperidin-3-yl]methyl 2-phenylbenzoate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1950509; BDBM50419830
Click to Show/Hide
|
||||
| Activity |
IC50 = 389045.14 nM
|
[13] | |||
| Compound Name |
3-Cyclopropyl-3-(dimethylamino)propyl dimethylcarbamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL480799; BDBM50254601
Click to Show/Hide
|
||||
| Activity |
EC50 = 1000000 nM
|
[10] | |||
| Compound Name |
3-(Dimethylamino)butyl 3-phenylpropylcarbamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL448084; BDBM50254543
Click to Show/Hide
|
||||
| Activity |
EC50 = 1000000 nM
|
[10] | |||
| Compound Name |
Methyl (3aR,5R,9bR)-7,9-dichloro-5-phenylsulfanyl-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-h]isoquinoline-1-carboxylate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL225181; BDBM50476211
Click to Show/Hide
|
||||
| Activity |
EC50 > 1000000 nM
|
[28] | |||
| Compound Name |
(4As,10bR)-1,2,3,4,4a,5,6,10b-octahydro-1,9-phenanthroline
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL224829; BDBM50476215
Click to Show/Hide
|
||||
| Activity |
EC50 > 1000000 nM
|
[28] | |||
| Compound Name |
Methyl (3aS,9bR)-9-chloro-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-h]isoquinoline-1-carboxylate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL374612; BDBM50476214
Click to Show/Hide
|
||||
| Activity |
EC50 > 1000000 nM
|
[28] | |||
| Compound Name |
Methyl (3aR,5R,9bR)-5-(benzenesulfonyl)-7,9-dichloro-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-h]isoquinoline-1-carboxylate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL224667; BDBM50476212
Click to Show/Hide
|
||||
| Activity |
EC50 > 1000000 nM
|
[28] | |||
| Compound Name |
3-(Dimethylamino)-3-(thiophen-3-yl)propyl dimethylcarbamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL479015; BDBM50254602
Click to Show/Hide
|
||||
| Activity |
EC50 = 1000000 nM
|
[10] | |||
| Compound Name |
1-(3-(Dimethylamino)butyl)-3-phenylurea
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL449566; BDBM50254599
Click to Show/Hide
|
||||
| Activity |
Ki = 1000000 nM
|
[10] | |||
| Compound Name |
3-(3-(Dimethylamino)butyl)-1,1-dimethylurea
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL457965; BDBM50254598
Click to Show/Hide
|
||||
| Activity |
Ki = 1000000 nM
|
[10] | |||
| Compound Name |
3-(Dimethylamino)-3-phenylpropyl dimethylcarbamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL479429; BDBM50254603
Click to Show/Hide
|
||||
| Activity |
EC50 = 1000000 nM
|
[10] | |||
| Compound Name |
3-(Dimethylamino)butyl 4-cyanophenyl(methyl)carbamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL466398; BDBM50254481
Click to Show/Hide
|
||||
| Activity |
EC50 = 1000000 nM
|
[10] | |||
| Compound Name |
(5S)-Spiro[1,3-oxazolidine-5,3'-1-azabicyclo[2.2.2]octane]-2-one
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
AR-R17779; CHEMBL193016; UNII-C3VZ57BN3M; C3VZ57BN3M; SCHEMBL676252; (-)-Spiro[1-azabicyclo(2.2.2)octane-3,5''-oxazolidin-2''-one]; ZINC7403; CTK8F0364; DTXSID60415499; ARR-1779; BCP24016; AR-R13489; BDBM50164613; AKOS015962649; Q4653530; (S)-Spiro[1-azabicyclo[2.2.2]octan-3,5'-oxazolidin]-2'-one; (3S)-Spiro[1-azabicyclo[2.2.2]octane-3,5'-oxazolidin]-2'-one; (S)-1''-azaspiro[oxazolidine-5,8''-bicyclo[2.2.2]octan]-2-one; (S)-4-Azaspiro[bicyclo[2.2.2]octane-2,5'-oxazolidin]-2'-one; (2S)-2''H-spiro[4-azabicyclo[2.2.2]octane-2,5''-[1,3]oxazolidin]-2''-one
Click to Show/Hide
|
||||
| Activity |
IC50 > 1000000 nM
|
[29] | |||
| Compound Name |
2-Phenyl-N-[[1-(3-phenylpropyl)piperidin-3-yl]methyl]benzamide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1950518; BDBM50419836
Click to Show/Hide
|
||||
| Activity |
IC50 = 100000000 nM
|
[13] | |||
| Click to Show/Hide the Information of All Non Binders | |||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | (S)-(-)-5-ethynyl-3-(1-methyl-2-pyrrolidinyl)pyridine maleate (SIB-1508Y): a novel anti-parkinsonian agent with selectivity for neuronal nicotinic acetylcholine receptors. J Med Chem. 1996 Aug 16;39(17):3235-7. | ||||
| REF 2 | Chemistry and Pharmacology of a Series of Unichiral Analogues of 2-(2-Pyrrolidinyl)-1,4-benzodioxane, Prolinol Phenyl Ether, and Prolinol 3-Pyridyl Ether Designed as alpha42-Nicotinic Acetylcholine Receptor Agonists. J Med Chem. 2015 Aug 27;58(16):6665-77. | ||||
| REF 3 | Novel nicotinic acetylcholine receptor agonists containing carbonyl moiety as a hydrogen bond acceptor. Bioorg Med Chem Lett. 2013 Jul 1;23(13):3927-34. | ||||
| REF 4 | Diazaspirocyclic compounds as selective ligands for the alpha42 nicotinic acetylcholine receptor. Bioorg Med Chem Lett. 2012 Aug 1;22(15):5089-92. | ||||
| REF 5 | Neuronal nicotinic acetylcholine receptors as targets for drug discovery. J Med Chem. 1997 Dec 19;40(26):4169-94. | ||||
| REF 6 | Recent developments in novel antidepressants targeting alpha42-nicotinic acetylcholine receptors. J Med Chem. 2014 Oct 23;57(20):8204-23. | ||||
| REF 7 | Discovery of N-[(3R,5R)-1-azabicyclo[3.2.1]oct-3-yl]furo[2,3-c]pyridine-5-carboxamide as an agonist of the alpha7 nicotinic acetylcholine receptor:... Bioorg Med Chem Lett. 2008 Jun 15;18(12):3611-5. | ||||
| REF 8 | Discovery of 3-(5-chloro-2-furoyl)-3,7-diazabicyclo[3.3.0]octane (TC-6683, AZD1446), a novel highly selective alpha4beta2 nicotinic acetylcholine receptor agonist for the treatment of cognitive disorders. J Med Chem. 2012 Nov 8;55(21):9181-94. | ||||
| REF 9 | US patent application no. 9303017B2, 2,5-disubstituted-pyridyl nicotinic ligands, and methods of use thereof | ||||
| REF 10 | Carbamoylcholine analogs as nicotinic acetylcholine receptor agonists--structural modifications of 3-(dimethylamino)butyl dimethylcarbamate (DMABC). Bioorg Med Chem Lett. 2009 Jan 1;19(1):87-91. | ||||
| REF 11 | Discovery and structure-activity relationship of quinuclidine benzamides as agonists of alpha7 nicotinic acetylcholine receptors. J Med Chem. 2005 Feb 24;48(4):905-8. | ||||
| REF 12 | Discovery of benzamide analogs as negative allosteric modulators of human neuronal nicotinic receptors: pharmacophore modeling and structure-activity relationship studies. Bioorg Med Chem. 2013 Aug 1;21(15):4730-43. | ||||
| REF 13 | 3D-QSAR and 3D-QSSR models of negative allosteric modulators facilitate the design of a novel selective antagonist of human alpha42 neuronal nicotinic acetylcholine receptors. Bioorg Med Chem Lett. 2012 Feb 15;22(4):1797-813. | ||||
| REF 14 | 3D-QSAR and QSSR studies of 3,8-diazabicyclo[4.2.0]octane derivatives as neuronal nicotinic acetylcholine receptors by comparative molecular field analysis (CoMFA). Bioorg Med Chem Lett. 2009 Jan 1;19(1):127-31. | ||||
| REF 15 | Synthesis and structure-activity relationship studies of 3,6-diazabicyclo[3.2.0]heptanes as novel alpha4beta2 nicotinic acetylcholine receptor selective agonists. J Med Chem. 2007 Nov 1;50(22):5493-508. | ||||
| REF 16 | Discovery of N-[(3R)-1-azabicyclo[2.2.2]oct-3-yl]furo[2,3-c]pyridine-5-carboxamide, an agonist of the alpha7 nicotinic acetylcholine receptor, for the potential treatment of cognitive deficits in schizophrenia: synthesis and structure--activity relationship. J Med Chem. 2006 Jul 13;49(14):4425-36. | ||||
| REF 17 | Structure-activity relationship studies of sulfonylpiperazine analogues as novel negative allosteric modulators of human neuronal nicotinic receptors. J Med Chem. 2011 Dec 22;54(24):8681-92. | ||||
| REF 18 | Design and synthesis of a novel series of 4-heteroarylamino-1'-azaspiro[oxazole-5,3'-bicyclo[2.2.2]octanes as alpha7 nicotinic receptor agonists 2. Development of 4-heteroaryl SAR. Bioorg Med Chem Lett. 2017 Mar 1;27(5):1261-1266. | ||||
| REF 19 | Discovery of Novel alpha42 Neuronal Nicotinic Receptor Modulators through Structure-Based Virtual Screening. ACS Med Chem Lett. 2011 Sep 18;2(11):855-60. | ||||
| REF 20 | Preparation and characterization of N-(3-pyridinyl) spirocyclic diamines as ligands for nicotinic acetylcholine receptors. Bioorg Med Chem Lett. 2009 Mar 15;19(6):1682-5. | ||||
| REF 21 | SAR of alpha7 nicotinic receptor agonists derived from tilorone: exploration of a novel nicotinic pharmacophore. Bioorg Med Chem Lett. 2012 Feb 15;22(4):1633-8. | ||||
| REF 22 | Discovery and optimization of substituted piperidines as potent, selective, CNS-penetrant alpha4beta2 nicotinic acetylcholine receptor potentiators. Bioorg Med Chem Lett. 2008 Oct 1;18(19):5209-12. | ||||
| REF 23 | Synthesis and characterization of in vitro and in vivo profiles of hydroxybupropion analogues: aids to smoking cessation. J Med Chem. 2010 Jun 24;53(12):4731-48. | ||||
| REF 24 | Discovery of a novel series of quinolone alpha7 nicotinic acetylcholine receptor agonists. Bioorg Med Chem Lett. 2013 Mar 15;23(6):1684-8. | ||||
| REF 25 | Drimane Sesquiterpenoids Noncompetitively Inhibit Human alpha42 Nicotinic Acetylcholine Receptors with Higher Potency Compared to Human alpha34 and alpha7 Subtypes. J Nat Prod. 2018 Apr 27;81(4):811-817. | ||||
| REF 26 | Neuronal nicotinic acetylcholine receptors: structural revelations, target identifications, and therapeutic inspirations. J Med Chem. 2005 Jul 28;48(15):4705-45. | ||||
| REF 27 | Novel acetylcholine and carbamoylcholine analogues: development of a functionally selective alpha4beta2 nicotinic acetylcholine receptor agonist. J Med Chem. 2008 Dec 11;51(23):7380-95. | ||||
| REF 28 | Coaxing a pyridine nucleus to give up its aromaticity: synthesis and pharmacological characterization of novel conformationally restricted analogues of nicotine and anabasine. J Med Chem. 2004 Dec 30;47(27):6691-701. | ||||
| REF 29 | Activity of alpha7-selective agonists at nicotinic and serotonin 5HT3 receptors expressed in Xenopus oocytes. Bioorg Med Chem Lett. 2004 Apr 19;14(8):1849-53. | ||||
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