BDBM50396198 CHEMBL2172043

SMILES: Cc1[nH]nc(C(O)=O)c1Cc1cccc(c1)-c1ccncc1

InChI Key: InChIKey=OKLLFGJYTCFXIM-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 50396198   

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
Hydroxyacid oxidase 2 (Rattus norvegicus)	BDBM50396198 (CHEMBL2172043) Show SMILES Cc1[nH]nc(C(O)=O)c1Cc1cccc(c1)-c1ccncc1 Show InChI InChI=1S/C17H15N3O2/c1-11-15(16(17(21)22)20-19-11)10-12-3-2-4-14(9-12)13-5-7-18-8-6-13/h2-9H,10H2,1H3,(H,19,20)(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Advinus Therapeutics Curated by ChEMBL					Assay Description Inhibition of rat Hao2-mediated oxidation of 2-hydroxyoctanoic acid assessed as proportionate release of H2O2				Bioorg Med Chem Lett 22: 4341-7 (2012) Article DOI: 10.1016/j.bmcl.2012.05.020 BindingDB Entry DOI: 10.7270/Q20866FZ
					More data for this Ligand-Target Pair