BDBM50069572 1-Benzo[1,2,5]thiadiazol-5-ylmethyl-4-(4-methoxy-phenyl)-2-oxo-1,2-dihydro-benzo[4,5]furo[3,2-b]pyridine-3-carboxylic acid::CHEMBL67971

SMILES: COc1ccc(cc1)-c1c(C(O)=O)c(=O)n(Cc2ccc3nsnc3c2)c2c3ccccc3oc12

InChI Key: InChIKey=WKNBOESFXYFZBY-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50069572   

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
EDNRA (RAT)	BDBM50069572 (1-Benzo[1,2,5]thiadiazol-5-ylmethyl-4-(4-methoxy-p...) Show SMILES COc1ccc(cc1)-c1c(C(O)=O)c(=O)n(Cc2ccc3nsnc3c2)c2c3ccccc3oc12 Show InChI InChI=1S/C26H17N3O5S/c1-33-16-9-7-15(8-10-16)21-22(26(31)32)25(30)29(13-14-6-11-18-19(12-14)28-35-27-18)23-17-4-2-3-5-20(17)34-24(21)23/h2-12H,13H2,1H3,(H,31,32)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Merck KGaA Curated by ChEMBL					Assay Description Inhibition of [125I]-ET-1 binding to rat aorta membrane Endothelin A receptor				Bioorg Med Chem Lett 8: 17-22 (1999) BindingDB Entry DOI: 10.7270/Q23B5Z9H
					More data for this Ligand-Target Pair
EDNRB (Homo sapiens (Human))	BDBM50069572 (1-Benzo[1,2,5]thiadiazol-5-ylmethyl-4-(4-methoxy-p...) Show SMILES COc1ccc(cc1)-c1c(C(O)=O)c(=O)n(Cc2ccc3nsnc3c2)c2c3ccccc3oc12 Show InChI InChI=1S/C26H17N3O5S/c1-33-16-9-7-15(8-10-16)21-22(26(31)32)25(30)29(13-14-6-11-18-19(12-14)28-35-27-18)23-17-4-2-3-5-20(17)34-24(21)23/h2-12H,13H2,1H3,(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Merck KGaA Curated by ChEMBL					Assay Description Inhibition of [125I]-ET-1 binding to porcine kidney inner medulla membrane Endothelin B receptor				Bioorg Med Chem Lett 8: 17-22 (1999) BindingDB Entry DOI: 10.7270/Q23B5Z9H
					More data for this Ligand-Target Pair