Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T19433 | Target Info | |||
| Target Name | Glutathione-dependent PGD synthase (HPGDS) | ||||
| Synonyms |
HPGDS; Glutathione-S-transferase; GST class-alpha
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| Target Type | Successful Target | ||||
| Gene Name | HPGDS | ||||
| Biochemical Class | Intramolecular oxidoreductases | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 22 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Ethacrynic acid
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Approved | Compound Info | ||
| Synonyms |
Crinuryl; Edecril; Edecrina; Endecril; Ethacrynate; Hidromedin; Hydromedin; Mingit; Otacril; Reomax; Taladren; Uregit; Acide etacrynique; Acido etacrinico; Acidum etacrynicum; Etacrinic acid; Etacrynic Acid; Etakrinic acid; Ethacrinic acid; Ethacryinic Acid; Kyselina ethakrynova; Kyselina ethakrynova [Czech]; Methylenebutyryl phenoxyacetic acid; Methylenebutyrylphenoxyacetic acid; E0526; MK 595; Acide etacrynique [INN-French]; Acido etacrinico [INN-Spanish]; Acidum etacrynicum [INN-Latin]; Edecrin (TN); Ethacrinique (acide); Ethacrynic Acid, Sodium Salt; Ethacrynic acid (USP); Ethacrynic acid [USAN:BAN]; MK-595; Etacrynic acid (JP15/INN); [2,3-Dichloro-4-(2-methylenebutyryl)phenoxy]acetic acid; [2,3-dichloro-4-(2-methylenebutanoyl)phenoxy]acetic acid; [2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid; [4-(2-Methylenebutyryl)-2,3-dichlorophenoxy]acetic acid; Kyselina 4-(2-(1-butenyl)karbonyl)-2,3-dichlorfenoxyoctova; Kyselina 4-(2-(1-butenyl)karbonyl)-2,3-dichlorfenoxyoctova [Czech]; [2,3-Dichloro-4-(2-methylene-1-oxobutyl)phenoxy]acetic acid; (2,3-Dichloro-4-(2-methylene-1-oxobutyl)phenoxy)acetic acid; (2,3-Dichloro-4-(2-methylenebutyryl)phenoxy)acetic acid; (2,3-Dichloro-4-[2-methylenebutyryl]phenoxy)acetic acid; (4-(2-Methylenebutyryl)-2,3-dichlorophenoxy)acetic acid; 2,3-Dichloro-4(2-methylene-butyryl)phenoxy] acetic acid; 2,3-Dichloro-4-(2-methylenebutyl)phenoxyacetic acid; 2,3-Dichloro-4-(2-methylenebutyryl)phenoxy acetic acid; 2,3-Dichloro-4-(2-methylenebutyryl)phenoxyacetic acid; 2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid
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| Activity |
IC50 = 122300 nM
|
[1] | |||
| Compound Name |
N-(1-Amino-3-methyl-1-oxobutan-2-yl)-4-(3-hydroxyphenyl)benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215372; BDBM50416550
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| Activity |
IC50 = 53300 nM
|
[2] | |||
| Compound Name |
N-(1-Amino-1-oxo-3-phenylpropan-2-yl)-4-thiophen-2-ylbenzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215515; BDBM50416545
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| Activity |
IC50 = 54000 nM
|
[2] | |||
| Compound Name |
N-(1-Amino-4-methyl-1-oxopentan-2-yl)-4-(3-hydroxyphenyl)benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215371; BDBM50416551
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| Activity |
IC50 = 57600 nM
|
[2] | |||
| Compound Name |
N-Benzhydryl-5-(1H-indol-4-yl)thiophene-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215232; BDBM50416553
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| Activity |
IC50 = 57900 nM
|
[2] | |||
| Compound Name |
N-(1-Amino-1-oxo-3-phenylpropan-2-yl)-2-hydroxy-4-(3-hydroxyphenyl)benzamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215446; BDBM50324481; N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3,3''-dihydroxybiphenyl-4-carboxamide
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| Activity |
IC50 = 61300 nM
|
[2] | |||
| Compound Name |
N-(1-Amino-4-methyl-1-oxopentan-2-yl)-5-(3-hydroxyphenyl)thiophene-2-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215295; BDBM50324487; N-(1-Amino-4-methyl-1-oxopentan-2-yl)-5-(3-hydroxyphenyl)-thiophene-2-carboxamide
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| Activity |
IC50 = 66900 nM
|
[2] | |||
| Compound Name |
N-Benzhydryl-2-(3-hydroxyphenyl)thiazole-4-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215162; BDBM50324489
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| Activity |
IC50 = 71200 nM
|
[2] | |||
| Compound Name |
N-[1-Amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-5-(3-hydroxyphenyl)thiophene-2-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215298; BDBM50324484; N-(1-Amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl)-5-(3-hydroxyphenyl)thiophene-2-carboxamide
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| Activity |
IC50 = 72500 nM
|
[2] | |||
| Compound Name |
N-(2-Amino-2-oxoethyl)-5-(3-hydroxyphenyl)thiophene-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215294; BDBM50324488
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| Activity |
IC50 = 73900 nM
|
[2] | |||
| Compound Name |
5-(3-Aminophenyl)-N-benzhydrylthiophene-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215160; BDBM50324490
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| Activity |
IC50 = 76400 nM
|
[2] | |||
| Compound Name |
N-Benzhydryl-5-(3-hydroxyphenyl)thiophene-2-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215159; BDBM50324491
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| Activity |
IC50 = 79200 nM
|
[2] | |||
| Compound Name |
2-Benzoylthiophene
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Investigative | Compound Info | ||
| Synonyms |
phenyl(thiophen-2-yl)methanone; Phenyl 2-thienyl ketone; Methanone, phenyl-2-thienyl-; Ketone, phenyl 2-thienyl; Phenyl(2-thienyl)methanone; MFCD00022495; phenyl-thiophen-2-yl-methanone; 2-Thienyl phenyl ketone; .alpha.-Benzoylthiophene; NSC-4502; CHEMBL567059; 2-benzoyl thiophene; EINECS 205-169-6; AI3-11217; phenyl-2-thienylmethanone; ACMC-1BT4J; ChemDiv2_003411; 2-Benzoylthiophene, 98%; phenyl(thien-2-yl)methanone; KSC497C5D; MLS000682816; ARONIS25091; BIDD:GT0337; Phenyl(2-thienyl)methanone #; SCHEMBL158020; CTK3J7151; DWYFUJJWTRPARQ-UHFFFAOYSA-; DTXSID30159191; NSC4502; HMS1378L01; HMS2600E06; ZINC160637; KS-000046ZU; ANW-19732; BBL027877; BDBM50300127; SBB032281; STK400202; AKOS000310023; CCG-202927; MCULE-4790732265; VT20104; NCGC00245936-01; AK-58341; AS-60103; SMR000312173; SY036770; DB-020554; ST4019631; AM20020418; B0308; FT-0611297; Y3200; A806865; SR-01000597211; J-006630; SR-01000597211-1
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| Activity |
IC50 = 83500 nM
|
[2] | |||
| Compound Name |
N-(1-Amino-1-oxo-3-phenylpropan-2-yl)-3''-hydroxybiphenyl-4-carboxamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215369; BDBM50324483
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| Activity |
IC50 = 88500 nM
|
[2] | |||
| Compound Name |
N-[(1-Amino-1-oxo-3-phenylpropan-2-yl)carbamoyl]-5-(3-hydroxyphenyl)thiophene-2-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215296; BDBM50324486; N-(1-Amino-1-oxo-3-phenylpropan-2-yl)-5-(3-hydroxyphenyl)-thiophene-2-carboxamide
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| Activity |
IC50 = 89500 nM
|
[2] | |||
| Compound Name |
N-[1-Amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-(3-hydroxyphenyl)benzamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215370; BDBM50324482; N-(1-Amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl)-30-hydroxybiphenyl-4-carboxamide
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| Activity |
IC50 = 91000 nM
|
[2] | |||
| Compound Name |
N-[[1-Amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-(3-hydroxyphenyl)thiophene-2-carboxamide
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215297; BDBM50324485; N-(1-Amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl)-5-(3-hydroxyphenyl)thiophene-2-carboxamide
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| Activity |
IC50 = 91300 nM
|
[2] | |||
| Compound Name |
4-{[4-(4-Fluoro-3-methylphenyl)-1,3-thiazol-2-yl]amino}-2-hydroxybenzoic acid
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|
Investigative | Compound Info | ||
| Synonyms |
Thiazolylamino, 12; Oprea1_648839; CHEMBL258467; BDBM21624; ZINC70745; HMS3604H07; STK003898; AKOS001673930; DB07616; MCULE-3145134821; EU-0013899; Q27096835
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| Activity |
IC50 = 94600 nM
|
[2] | |||
| Compound Name |
n-(1-Amino-1-oxo-3-phenylpropan-2-yl)-6-(thiophen-2-yl)nicotinamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1215516; SCHEMBL38259; BDBM50324480; N-(1-amino-1-oxo-3-phenylpropan-2-yl)-6-thiophen-2-ylpyridine-3-carboxamide
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| Activity |
IC50 = 97000 nM
|
[2] | |||
| Compound Name |
2-Phenyl-5-(1H-pyrazol-3-yl)-1,3-thiazole
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Investigative | Compound Info | ||
| Synonyms |
Phenyl-5-(1h-Pyrazol-3-Yl)-1,3-Thiazole; 2-Phenyl-5-(1H-pyrazol-3-yl)thiazole; 2-phenyl-5-(1H-pyrazol-5-yl)-1,3-thiazole; Pyrazolylthiazole, 13; Bionet2_000868; MLS000707223; CHEMBL261777; SCHEMBL1245913; BDBM21625; CTK5J6120; CTK8F4509; HMS1366H10; HMS2650E11; HMS3604E09; KS-00001VL4; ZINC3883784; MFCD00974300; SBB097159; AKOS005070206; DB07614; MCULE-9091986717; 2-phenyl-5-(1H-pyrazol-5-yl)thiazole; 2-phenyl-5-pyrazol-3-yl-1,3-thiazole; SMR000334606; 3M-061; 728P308; Q27096834; 2-phenyl-5-(1H-pyrazol-3-yl)-1,3-thiazole, AldrichCPR
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| Activity |
IC50 = 97700 nM
|
[2] | |||
| Compound Name |
2-(4-Methoxybenzoyl)thiophene
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Investigative | Compound Info | ||
| Synonyms |
(4-methoxyphenyl)(thiophen-2-yl)methanone; 2-(p-Methoxybenzoyl)thiophene; p-Anisyl thiophen-2-yl ketone; (4-methoxyphenyl)-thiophen-2-ylmethanone; 4-methoxyphenyl 2-thienyl ketone; MFCD00005440; NSC-151248; methanone, (4-methoxyphenyl)-2-thienyl-; CHEMBL583291; (4-methoxyphenyl)(2-thienyl)methanone; EINECS 223-997-6; NSC151248; PubChem10833; ACMC-1AIKH; 2-Thienyl p-anisyl ketone; BIDD:GT0545; SCHEMBL3157724; CTK3J5866; DTXSID70194425; ZINC119788; ANW-72935; BDBM50300125; SBB056945; AKOS009157374; AC-4587; MCULE-7534597838; QC-7337; VT20452; KS-000016X6; AS-64984; DB-050777; A6856; FT-0608657; M2395; ST50308571; J-506029
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| Activity |
IC50 = 105000 nM
|
[1] | |||
| Compound Name |
2-Phenyl-5-(2-phenylpyrimidin-5-yl)oxazole
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Investigative | Compound Info | ||
| Synonyms |
SCHEMBL2317623; CHEMBL3931258; BDBM179468; US9126973, 46; 2-phenyl-5-(2-phenylpyrimidin-5-yl)-1,3-oxazole
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| Activity |
IC50 = 125000 nM
|
[3] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 2 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Oxfendazole
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Investigative | Compound Info | ||
| Synonyms |
Fenbendazole sulfoxide; Synanthic; Systamex; Repidose; Systemax; fenbendazole S-oxide; Oxfendazolum; Oxfendazol; Synanthic (Veterinary); RS-8858; 5-Phenylsulfinyl-2-carbomethoxyaminobenzimidazole; RS 8858; UNII-OMP2H17F9E; HOE 8105; Oxfendazole (USP/INN); OMP2H17F9E; CHEMBL42442; NCGC00095157-04; DSSTox_CID_24112; DSSTox_RID_80103; DSSTox_GSID_44112; Oxfendazol [INN-Spanish]; Oxfendazolum [INN-Latin]; Oxfendazole [USAN:BAN:INN]; FBZ-SO; EINECS 258-714-5; BRN 0761290; Benzelmin; Nanthic; CCRIS 9430; Synanthic (TN); Oxfendazole [USAN:USP:INN:BAN]; Fenbendazole sulphoxide; Spectrum2_001704; Spectrum3_001972; Oprea1_563224; SCHEMBL44121; BSPBio_003572; MLS004712073; Synanthic [veterinary] (TN); SPECTRUM1505296; SPBio_001688; SCHEMBL9818561; DTXSID9044112; CTK8E8695; KBio3_002947; HMS1922B08; HMS2090F19; HMS2093O16; HMS3655M14; HMS3715E09; Pharmakon1600-01505296; BCP09602; HY-B0291; Oxfendazole (Fenbendazole Sulfoxide); Tox21_113444; Tox21_302383; BDBM50300124; CCG-39503; MFCD00801063; NSC758943; s1830; STK378905; Fenbendazole Sulphoxide (Oxfendazole); AKOS005448898; AKOS015918230; Tox21_113444_1; AC-8715; CCG-220984; DB11446; KS-5036; MCULE-2247044354; NSC-758943; NCGC00095157-01; NCGC00095157-02; NCGC00095157-03; NCGC00095157-05; NCGC00095157-06; NCGC00255714-01; AK546755; SC-18524; SMR001550468; Oxfendazole 100 microg/mL in Acetonitrile; SBI-0206760.P001; AB0013301; DB-052387; FT-0630662; O0391; ST50865840; SW199450-2; C21882; D05291; AB01275512-01; AB01275512_02; AB01275512_03; Oxfendazole, VETRANAL(TM), analytical standard; 716O500; A829749; SR-01000872713; Q-201525; Q7115199; SR-01000872713-1; BRD-A33447119-001-02-5; BRD-A33447119-001-03-3; BRD-A33447119-001-05-8
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| Activity |
IC50 > 300000 nM
|
[1] | |||
| Compound Name |
1-Phenyl-1H-pyrazole-4-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
1-Phenylpyrazole-4-carboxylic acid; 1H-Pyrazole-4-carboxylic acid, 1-phenyl-; Pyrazole-4-carboxylic acid, 1-phenyl-; MFCD00514518; 1-phenylpyrazole-4-carboxylate; BRN 0139486; Pyrazole, 1; 1-Phenyl-1h-pyrazol-4-carboxylic acid; 1-Phenyl-1H-pyrazole-4-carboxylicacid; ACMC-1C9E6; SCHEMBL70281; 5-25-04-00056 (Beilstein Handbook Reference); 1-phenylpyrazole-4-carboxylic; CHEMBL406105; BDBM21615; CTK0H8017; DTXSID20150399; HMS1741L17; HMS3604M12; ACT07623; ALBB-000149; KS-00003KT5; ZINC4218283; ANW-72862; BBL012453; SBB014249; STK414996; AKOS000206849; AB06399; AS06559; CM10524; DB08790; FS-3391; MCULE-7197599645; VP20045; 1H-Pyrazole-4-carboxylicacid, 1-phenyl-; AK-32875; BR-32875; 1-Phenyl-1H-pyrazole-4-carboxylic acid #; AB0034836; ST4133997; AM20020222; BB 0219785; FT-0649573; X9057; EN300-14398; C-1240; 1H-PYRAZOLE-4-CARBOXYLIC ACID, 1-PHENYL; 514P518; W-204816; Q27097971; Z99601182
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| Activity |
IC50 = 890000 nM
|
[4] | |||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Identification and characterisation of new inhibitors for the human hematopoietic prostaglandin D2 synthase. Eur J Med Chem. 2010 Feb;45(2):447-54. | ||||
| REF 2 | Development and characterization of new inhibitors of the human and mouse hematopoietic prostaglandin D(2) synthases. J Med Chem. 2010 Aug 12;53(15):5536-48. | ||||
| REF 3 | US patent application no. 9126973B2, Multiheteroaryl compounds as inhibitors of H-PGDS and their use for treating prostaglandin D2 mediated diseases | ||||
| REF 4 | Novel prostaglandin D synthase inhibitors generated by fragment-based drug design. J Med Chem. 2008 Apr 10;51(7):2178-86. | ||||
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