BDBM50423777 OXYPURINOL::Oxipurinol

SMILES: O=c1[nH]c2n[nH]cc2c(=O)[nH]1

InChI Key: InChIKey=HXNFUBHNUDHIGC-UHFFFAOYSA-N

Data: 2 KI  1 Kd

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50423777   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Xanthine dehydrogenase (Homo sapiens (Human))	BDBM50423777 (OXYPURINOL | Oxipurinol) Show SMILES O=c1[nH]c2n[nH]cc2c(=O)[nH]1 Show InChI InChI=1S/C5H4N4O2/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MMDB PC cid PC sid UniChem Similars	Article PubMed	35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of human xanthine oxidase				J Nat Prod 77: 1693-9 (2014) Article DOI: 10.1021/np500320g BindingDB Entry DOI: 10.7270/Q2QJ7M9S
					More data for this Ligand-Target Pair
Xanthine dehydrogenase (Homo sapiens (Human))	BDBM50423777 (OXYPURINOL | Oxipurinol) Show SMILES O=c1[nH]c2n[nH]cc2c(=O)[nH]1 Show InChI InChI=1S/C5H4N4O2/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MMDB PC cid PC sid UniChem Similars	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of oxidized form of human xanthine oxidase				J Nat Prod 77: 1693-9 (2014) Article DOI: 10.1021/np500320g BindingDB Entry DOI: 10.7270/Q2QJ7M9S
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Mycobacterium tuberculosis)	BDBM50423777 (OXYPURINOL | Oxipurinol) Show SMILES O=c1[nH]c2n[nH]cc2c(=O)[nH]1 Show InChI InChI=1S/C5H4N4O2/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	7.94E+5	n/a	n/a	n/a	n/a	n/a
Pontif£cia Universidade Cat£lica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to Mycobacterium tuberculosis purine nucleoside phosphorylase by spectrophotometric analysis				Bioorg Med Chem 18: 4769-74 (2011) Article DOI: 10.1016/j.bmc.2010.05.009 BindingDB Entry DOI: 10.7270/Q2TQ62T5
					More data for this Ligand-Target Pair