Target Poor or Non Binder(s) Information

Target General Information

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Target ID

T28925

Target Info

Target Name

Inosine-5'-monophosphate dehydrogenase (IMPDH)

Target Type

Successful Target

Gene Name

NO-GeName

Biochemical Class

Short-chain dehydrogenases reductase

UniProt ID

Family

Poor Binders of This Target (in total, 7 binders)

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Compound Name

6-Chloropurine Riboside, 5'-Monophosphate

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Investigative

Compound Info

Synonyms

6-Cl-Purine Ribotide; CHEMBL1683023; 6-Chloropurine riboside 5'-phosphate; 6-Chloropurine riboside 5'-monophosphate; 6-Chloropurine ribotide; AC1L4ML7; AC1Q3SV8; 6-Chloroinosine monophosphate; SCHEMBL622623; 6-chloro-9-(5-o-phosphono-; A-d-ribofuranosyl)-9h-purine; ALOBOMYIOYNCBS-KQYNXXCUSA-N; ZINC13526959; BDBM50222697; A8843; 6-Chloropurine 9-beta-D-ribofuranosyl 5'-monophosphate; 6-Chloro-9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purine; [(2R,3S,4R,5R)-5-(6-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen pho

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Activity

Ki = 62000 nM

[1]

Compound Name

4-Hydroxycarbazole

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Investigative

Compound Info

Synonyms

9H-Carbazol-4-ol; 4-Hydroxy carbazole; 4-hydroxycarbazol; UNII-3D95E7727V; CHEMBL46723; MFCD02178385; 3D95E7727V; 4-HYDROXY-9H-CARBAZOLE;9H-Carbazol-4-ol; 4-Hydroxycarbazole, 98+%; CCRIS 5300; EINECS 258-034-9; 5-hydroxycarbazole; 4-hydroxy-carbazole; PubChem9190; 4-Hydroxycarbazole, 95%; ACMC-209l0g; EC 258-034-9; KSC269K0J; SCHEMBL151982; CTK1G9504; UEOHATPGKDSULR-UHFFFAOYSA-; DTXSID60200584; BCP08901; KS-000009EI; ZINC2391423; ANW-31502; BDBM50127697; AKOS007930133; AC-1995; CM14413; KS-1022; VZ29213; AK-84880; BP-12456; BR-84880; SC-05050; SY036873; AB0012258; DB-026238; FT-0618683; FT-0681169; 02H398; M-2544; A1-00281; W-105811; Q27257069

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Activity

IC50 = 54000 nM

[2]

Compound Name

6,7-Dimethyl-4-oxo-2,3-dihydrochromene-3-carbonitrile

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Investigative

Compound Info

Synonyms

CHEMBL45926; BDBM50220680

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Activity

IC50 = 88000 nM

[2]

Compound Name

5-Cyanoindole

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Investigative

Compound Info

Synonyms

1H-Indole-5-carbonitrile; INDOLE-5-CARBONITRILE; 5-Cyano-1H-indole; 5-Cyano indole; MFCD00005669; CHEMBL294926; 5-Cyanoindole, 99%; EINECS 239-986-4; 5-cyano-indole; 5-Indolecarbonitrile; indol-5-carbonitrile; Indole, 5-cyano-; PubChem7326; ACMC-1BSBB; SCHEMBL91366; KSC179A2T; Indole-5-carbonitrile, 99%; CTK0H9029; DTXSID40166477; ZINC157017; ACN-S002760; ACT03557; ALBB-022905; BCP26499; CS-M1444; KS-000006VD; STR04400; ANW-21773; BBL009293; BDBM50220678; SBB004148; STK802138; AKOS005206715; AC-7424; CG-0514; MCULE-5838052662; PB25883; SB20070; NCGC00340972-01; AK-32216; BP-10151; BR-32216; SC-01412; SY006206; AB0008214; DB-014571; AM20060210; FT-0627223; FT-0627224; ST50823781; 61C242; A-1826; AB01331743-02; F2158-0363; Z1741968206; A3327A31-2A0C-4860-8157-F2773DE25B9E

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Activity

IC50 = 99000 nM

[2]

Compound Name

[(2S,3R,4S)-5-(2-Chloro-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

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Investigative

Compound Info

Synonyms

CHEMBL611590; BDBM50225282

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Activity

Ki = 120000 nM

[3]

Compound Name

4-Amino-7-chloroquinoline

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Investigative

Compound Info

Synonyms

7-chloroquinolin-4-amine; 7-Chloro-4-aminoquinoline; 4-Quinolinamine, 7-chloro-; 7-Chloro-quinolin-4-ylamine; UNII-2SJ6Y866TU; CHEMBL44789; 2SJ6Y866TU; GNF-PF-5425; 7-chloro-4-quinolylamine; (7-chloroquinolin-4-yl)-amine; NSC13; NSC 13; ACMC-1BNRI; 4-Quinolinamine,7-chloro-; Cambridge id 5511102; 4-amino-7-chloro-quinoline; (7-chloro-4-quinolyl)amine; 7-Chloro-4-quinolinamine #; SCHEMBL596040; NSC-13; BDBM23300; CTK4B1521; (7-chloro-quinolin-4-yl)-amine; DTXSID00152593; ZINC436635; BCP33126; CS-D0096; ANW-17389; BBL029042; MFCD00828822; SBB089481; STL162609; AKOS002669413; 4-Amino-7-chloroquinoline, AldrichCPR; AB07356; MCULE-7701973170; AC-18574; AS-35920; DB-041504; FT-0633467; ST51070811; X9401; B-6609; 198A409; 4-amino-7-chloroquinoline (ACQ)-based compound, 5; F9995-2431; 7-Chloro-4-quinolinamine pound>>4-Quinolinamine, 7-chloro-

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Activity

IC50 = 168000 nM

[2]

Compound Name

[(2S,3R,4S)-3,4-Dihydroxy-5-(6-oxo-2-propyl-1H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate

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Investigative

Compound Info

Synonyms

CHEMBL609835; BDBM50225281

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Activity

Ki = 190000 nM

[3]

Click to Show/Hide the Information of All Poor Binders

Non Binders of This Target (in total, 2 non binders)

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Compound Name

[(2S,3R,4S)-3,4-Dihydroxy-5-(2-methyl-6-oxo-1H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate

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Investigative

Compound Info

Synonyms

CHEMBL610157; BDBM50225283; BDBM50367210

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Activity

Ki = 600000 nM

[3]

Compound Name

4-Hydroxy-2-methylacetophenone

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Investigative

Compound Info

Synonyms

4'-Hydroxy-2'-methylacetophenone; 1-(4-Hydroxy-2-methylphenyl)ethanone; Ethanone, 1-(4-hydroxy-2-methylphenyl)-; 2-Methyl-4-hydroxyacetophenone; UNII-8K85H86ZED; CHEMBL47807; 8K85H86ZED; 1-acetyl-4-hydroxy-2-methylbenzene; Ethanone,1-(4-hydroxy-2-methylphenyl)-; 4'-Hydroxy-2'-methylacetophenone, 97%; 2'-methyl-4'-hydroxyacetophenone; NSC63364; EINECS 212-874-2; MFCD00002303; 1-(4-Hydroxy-2-methyl-phenyl)-ethanone; ACMC-209qod; 1-(4-hydroxy-2-methylphenyl)ethan-1-one; 4-Acetyl-3-methylphenol; SCHEMBL96129; 2-methyl-4hydroxyacetophenone; KSC658M6B; CTK5F8660; DTXSID60236363; 4'-hydroxy-2'-methyl acetophenone; 4'-hydroxy-2'-methyl-acetophenone; (4-hydroxy-2-methylphenyl)ethanone; BCP22830; KS-00000O4X; ZINC1691583; AM1211; ANW-38843; BBL036109; BDBM50220613; NSC-63364; SBB063800; STL444724; AKOS000112425; AS04594; BCP9000042; CS-W010970; MCULE-6173604252; SB39272; VZ27382; 1-(4-Hydroxy-2-methyl-phenyl)ethanone; 1-(2-methyl-4-oxidanyl-phenyl)ethanone; 4'-Hydroxy-2'-methylacetophenone, 98%; 1-(4-Hydroxy-2-methylphenyl)ethanone #; AK-50197; AS-17850; DB-028903; FT-0633053; ST50331360; V2157; A-8004; A842262; Q27159519; 2-{1-[(5-Methyl-2-furyl)methyl]-3-oxo-2-piperazinyl}aceticacid

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Activity

IC50 = 620000 nM

[2]

References

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REF 1

Inhibition of inosine monophosphate dehydrogenase (IMPDH) by 2-[2-(Z)-fluorovinyl]inosine 5'-monophosphate. Bioorg Med Chem Lett. 2003 Feb 24;13(4):645-7.

REF 2

Discovery of novel low molecular weight inhibitors of IMPDH via virtual needle screening. Bioorg Med Chem Lett. 2003 May 19;13(10):1691-4.

REF 3

Inhibitors of inosinic acid dehydrogenase. 2-Substituted inosinic acids. J Med Chem. 1984 Apr;27(4):429-32.

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