BindingDB

null

SMILES N#Cc1cc(ccn1)-c1n[nH]c(n1)-c1ccncc1

InChI Key InChIKey=UBVZQGOVTLIHLH-UHFFFAOYSA-N

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50267750

Xanthine dehydrogenase/oxidase(Bos taurus (Bovine))
Department of Chemistry, Faculty of Medicine, University of Ni?, Bulevar Dr Zorana?in?i?a 81, 18000 Ni?, Serbia.

Curated by ChEMBL

BDBM50267750(CHEMBL1078685)copy SMILEScopy InChI

Ki: 5.70nMAssay Description:Competitive inhibition of bovine milk xanthine oxidoreductase assessed as reduction in uric acid formation by spectrophotometric assayMore data for this Ligand-Target Pair

PDB MMDB KEGG
UniProtKB/SwissProt
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Details Article
BindingDB Entry DOI: 10.7270/Q2VD71XPPubMed PDB

3D Structure (crystal)

Targets 2 ▿
- Xanthine dehydrogenase/oxidase 7
- Broad substrate specificity ATP-binding cassette transporter ABCG2 1
Publications 7 ▿
- Eur J Med Chem 135: 491-516 (2017) 1
- Bioorg Med Chem Lett 29: 525-528 (2019) 1
- Eur J Med Chem 146: 668-677 (2018) 1
- Eur J Med Chem 183: (2019) 1
- Eur J Med Chem 141: 362-372 (2017) 1
- Eur J Med Chem 166: 186-196 (2019) 1
- Eur J Med Chem 140: 20-30 (2017) 1
Institutions 6 ▿
- [China Medical University] 2
- [Shenyang Pharmaceutical University, West China Hospital of Sichuan University, South China University of Technology, Guangzhou General Pharmaceutical Research Institute Co., Department of Chemistry, Faculty of Medicine, University of Ni?, Bulevar Dr Zorana?in?i?a 81, 18000 Ni?, Serbia.] 1
- [Shenyang Pharmaceutical University, West China Hospital of Sichuan University, South China University of Technology, Guangzhou General Pharmaceutical Research Institute Co., Department of Chemistry, Faculty of Medicine, University of Ni?, Bulevar Dr Zorana?in?i?a 81, 18000 Ni?, Serbia.] 1
- [Shenyang Pharmaceutical University, West China Hospital of Sichuan University, South China University of Technology, Guangzhou General Pharmaceutical Research Institute Co., Department of Chemistry, Faculty of Medicine, University of Ni?, Bulevar Dr Zorana?in?i?a 81, 18000 Ni?, Serbia.] 1
- [Shenyang Pharmaceutical University, West China Hospital of Sichuan University, South China University of Technology, Guangzhou General Pharmaceutical Research Institute Co., Department of Chemistry, Faculty of Medicine, University of Ni?, Bulevar Dr Zorana?in?i?a 81, 18000 Ni?, Serbia.] 1
- [Shenyang Pharmaceutical University, West China Hospital of Sichuan University, South China University of Technology, Guangzhou General Pharmaceutical Research Institute Co., Department of Chemistry, Faculty of Medicine, University of Ni?, Bulevar Dr Zorana?in?i?a 81, 18000 Ni?, Serbia.] 1
Affinity: 4.8 to 5.3E+3 nM▿
- Ki 2
- IC50 6
- Affinity ≤ nM
Xtal structures: 1
Docked structures: 0
Catalog Cmpds: 1