BDBM50170226 CHEMBL92084

SMILES: Cc1c(Cl)cnc2nc(O)c(O)nc12

InChI Key: InChIKey=DSEFKRFEJDNAGA-UHFFFAOYSA-N

Data: 1 KI  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 4 hits for monomerid = 50170226   

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
Glutamate receptor ionotropic, NMDA 1 (RAT)	BDBM50170226 (CHEMBL92084) Show SMILES Cc1c(Cl)cnc2nc(O)c(O)nc12 Show InChI InChI=1S/C8H6ClN3O2/c1-3-4(9)2-10-6-5(3)11-7(13)8(14)12-6/h2H,1H3,(H,11,13)(H,10,12,14)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars		2.88E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description In vitro binding affinity for glycine site on the NMDA receptor.				Citation and Details BindingDB Entry DOI: 10.7270/Q2CN762M
					More data for this Ligand-Target Pair
D-Amino Acid Oxidase (DAAO) (Rattus norvegicus (rat))	BDBM50170226 (CHEMBL92084) Show SMILES Cc1c(Cl)cnc2nc(O)c(O)nc12 Show InChI InChI=1S/C8H6ClN3O2/c1-3-4(9)2-10-6-5(3)11-7(13)8(14)12-6/h2H,1H3,(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	4.16E+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
D-Amino Acid Oxidase (DAAO) (Sus scrofa (pig))	BDBM50170226 (CHEMBL92084) Show SMILES Cc1c(Cl)cnc2nc(O)c(O)nc12 Show InChI InChI=1S/C8H6ClN3O2/c1-3-4(9)2-10-6-5(3)11-7(13)8(14)12-6/h2H,1H3,(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	260	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 (Homo sapiens (Human))	BDBM50170226 (CHEMBL92084) Show SMILES Cc1c(Cl)cnc2nc(O)c(O)nc12 Show InChI InChI=1S/C8H6ClN3O2/c1-3-4(9)2-10-6-5(3)11-7(13)8(14)12-6/h2H,1H3,(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	1.13E+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