Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T75498 | Target Info | |||
| Target Name | Quinone reductase 2 (NQO2) | ||||
| Synonyms |
Quinone oxidoreductase 2; Qui reductase 2; QR2; NRH:quinone oxidoreductase 2; NRH:qui oxidoreductase 2; NQO2; NAD(P)H qui oxidoreductase 2
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| Target Type | Successful Target | ||||
| Gene Name | NQO2 | ||||
| Biochemical Class | Diphenol donor oxidoreductase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 5 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Dabigatran
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Approved | Compound Info | ||
| Synonyms |
Pradaxa (TN)
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| Activity |
Ki = 60000 nM
|
[1] | |||
| Compound Name |
Casimiroin
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Investigative | Compound Info | ||
| Synonyms |
UNII-1X2A1U6BH3; 6-methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8-one; 1X2A1U6BH3; 6-Methoxy-9-methyl-(1,3)dioxolo(4,5-h)quinolin-8(9H)-one; 1,3-Dioxolo(4,5-h)quinolin-8(9H)-one, 6-methoxy-9-methyl-; 6-Methoxy-9-methyl-[1,3]dioxolo[4,5-h]quinolin-8(9H)-one; CHEMBL492762; SCHEMBL6244731; BDBM29210; CTK1D6483; DTXSID90197256; 6-methoxy-9-methyl[1,3]dioxolo[4,5-h]quinolin-8(9H)-one; ZINC900156; DB08744; C10654; Q27097930; 4-Methoxy-1-methyl-7,8-methylenedioxy-2(1H)-quinolinone; 6-Methoxy-9-methyl-1,3-Dioxolo(4,5-h)quinolin-8(9H)-one; 6-methoxy-9-methyl[1,3]dioxolo[4,5-h]quinolin-8(9 h)-one; 6-Methoxy-9-methyl-1,3-dioxolo[4,5-h]quinolin-8(9H)-one, 9CI; 6-Methoxy-9-methyl-9-hydro-2H-1,3-dioxolano[4,5-h]quinolin-8-one; 6-METHOXY-9-METHYL-2H,8H,9H-[1,3]DIOXOLO[4,5-H]QUINOLIN-8-ONE
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| Activity |
IC50 = 54100 nM
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[2] | |||
| Compound Name |
Tolazine
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Investigative | Compound Info | ||
| Synonyms |
2-methylphenazine; Phenazine, 2-methyl-; CHEMBL1802262; 2-Methylphenazin; SCHEMBL4359997; DTXSID70144046; ZINC4186665; BDBM50347473; NSC402914; AKOS002664692; NSC-402914
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| Activity |
IC50 = 60800 nM
|
[3] | |||
| Compound Name |
N-[(5-Methoxy-2-oxospiro[1H-indole-3,3'-bicyclo[2.2.1]heptane]-2'-yl)methyl]acetamide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL4076015; BDBM50269228
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| Activity |
IC50 = 63000 nM
|
[4] | |||
| Compound Name |
Dimethyl 7-acetamido-5-chloroquinoline-2,4-dicarboxylate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1945621; BDBM50363362
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| Activity |
IC50 ~ 100000 nM
|
[5] | |||
| Non Binders of This Target (in total, 4 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Casimiroin analogue, 1r
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL455593; BDBM29229
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| Activity |
IC50 > 500000 nM
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[2] | |||
| Compound Name |
Casimiroin analogue, 1q
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL493182; BDBM29228
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| Activity |
IC50 > 500000 nM
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[2] | |||
| Compound Name |
4-Methylquinolin-2-ol
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Investigative | Compound Info | ||
| Synonyms |
2-Hydroxy-4-methylquinoline; 4-methylquinolin-2(1H)-one; 4-Methyl-2-quinolinol; 2-Hydroxylepidine; 4-Methyl-2-quinolone; 4-Methylcarbostyril; 4-Methyl-2-hydroxyquinoline; 2(1H)-Lepidinone; 4-Methyl-1H-quinolin-2-one; 2-Lepidinol; 2(1H)-Quinolinone, 4-methyl-; 4-Methyl-2(1H)-quinolinone; 4-Methylquinolin-2-one; Carbostyril, 4-methyl-; NSC 2057; 4-methyl-quinolin-2-ol; AI3-00843; NSC2057; EINECS 210-139-0; Lepidine, 2-hydroxy; PubChem5862; 4-Methylquinol-2-one; ACMC-1ATIM; casimiroin analogue, 1c; 2-Quinolinol, 4-methyl-; Cc1cc([O])nc2ccccc12; 4-methylhydroquinolin-2-one; Oprea1_272485; Oprea1_547052; Oprea1_780405; cid_69088; MLS000096591; SCHEMBL377555; ARONIS003785; CHEMBL424414; BDBM29214; CTK3E9909; DTXSID20976132; HMS1722B17; HMS2320G05; ALBB-026701; BCP33184; KS-00001VO4; NSC-2057; ZINC8586366; 2-Hydroxy-4-methylquinoline, 97%; ANW-33569; BBL010584; MFCD00006745; SBB003978; STK038061; STL304705; 1,2-Dihydro-4-methyl-2-oxoquinoline; AKOS000120372; AKOS001041007; 3N-601S; DS-1525; MCULE-8758121655; QC-1595; SDCCGMLS-0027272.P002; Carbostyril, 4-methyl- (VAN) (8CI); NCGC00036814-02; NCGC00036814-03; NCGC00036814-04; NCGC00036814-05; NCGC00036814-06; NCGC00036814-07; AK-38350; BR-38350; SC-46615; SMR000062448; AB0026993; DB-053698; CS-0097736; FT-0612620; ST45023855; W8764; Y5486; S-4157; A832875; 4-Methylquinolin-2-ol;4-Methylquinolin-2(1H)-one; J-515819; Q27121422; F0109-0047; F0183-0103
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| Activity |
IC50 > 500000 nM
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[2] | |||
| Compound Name |
1,4-Dimethylquinoline-2,5,8(1H)-trione
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Investigative | Compound Info | ||
| Synonyms |
quinone, 12; CHEMBL450666; BDBM29230; 1,4-dimethylquinoline-2,5,8-trione
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| Activity |
IC50 > 500000 nM
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[2] | |||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Dabigatran and dabigatran ethyl ester: potent inhibitors of ribosyldihydronicotinamide dehydrogenase (NQO2). J Med Chem. 2012 Apr 26;55(8):3934-44. | ||||
| REF 2 | Synthesis of casimiroin and optimization of its quinone reductase 2 and aromatase inhibitory activities. J Med Chem. 2009 Apr 9;52(7):1873-84. | ||||
| REF 3 | Potential chemopreventive agents based on the structure of the lead compound 2-bromo-1-hydroxyphenazine, isolated from Streptomyces species, strain CNS284. J Med Chem. 2010 Dec 23;53(24):8688-99. | ||||
| REF 4 | Oxindole-based intraocular pressure reducing agents. Bioorg Med Chem Lett. 2017 Aug 15;27(16):3787-3793. | ||||
| REF 5 | Design, synthesis, and biological evaluation of potent quinoline and pyrroloquinoline ammosamide analogues as inhibitors of quinone reductase 2. J Med Chem. 2012 Jan 12;55(1):367-77. | ||||
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