BDBM50170225 CHEMBL3805223

SMILES: Clc1cnc2[nH]c(=O)c(=O)[nH]c2c1Br

InChI Key: InChIKey=WXVOPPXUDKVAEI-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50170225   

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
D-amino-acid oxidase (Homo sapiens (Human))	BDBM50170225 (CHEMBL3805223) Show SMILES Clc1cnc2[nH]c(=O)c(=O)[nH]c2c1Br Show InChI InChI=1S/C7H3BrClN3O2/c8-3-2(9)1-10-5-4(3)11-6(13)7(14)12-5/h1H,(H,11,13)(H,10,12,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Jiao Tong University Curated by ChEMBL					Assay Description Inhibition of human recombinant DAAO using D-alanine as substrate assessed as pyruvate production incubated for 60 mins by microplate reader analysis				Eur J Med Chem 117: 19-32 (2016) BindingDB Entry DOI: 10.7270/Q2V989ZS
					More data for this Ligand-Target Pair
D-Amino Acid Oxidase (DAAO) (Sus scrofa (pig))	BDBM50170225 (CHEMBL3805223) Show SMILES Clc1cnc2[nH]c(=O)c(=O)[nH]c2c1Br Show InChI InChI=1S/C7H3BrClN3O2/c8-3-2(9)1-10-5-4(3)11-6(13)7(14)12-5/h1H,(H,11,13)(H,10,12,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Jiao Tong University Curated by ChEMBL					Assay Description Inhibition of DAAO in porcine kidney homogenate using D-alanine as substrate assessed as pyruvate production incubated for 5 mins by microplate reade...				Eur J Med Chem 117: 19-32 (2016) BindingDB Entry DOI: 10.7270/Q2V989ZS
					More data for this Ligand-Target Pair
D-Amino Acid Oxidase (DAAO) (Rattus norvegicus (rat))	BDBM50170225 (CHEMBL3805223) Show SMILES Clc1cnc2[nH]c(=O)c(=O)[nH]c2c1Br Show InChI InChI=1S/C7H3BrClN3O2/c8-3-2(9)1-10-5-4(3)11-6(13)7(14)12-5/h1H,(H,11,13)(H,10,12,14)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.99E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Jiao Tong University Curated by ChEMBL					Assay Description Inhibition of rat spinal DAAO using D-alanine as substrate assessed as pyruvate production incubated for 60 mins by microplate reader analysis				Eur J Med Chem 117: 19-32 (2016) BindingDB Entry DOI: 10.7270/Q2V989ZS
					More data for this Ligand-Target Pair