BDBM50441611 CHEMBL2437180

SMILES: O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=S)NCc1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=IMQFZSWVQFOADL-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 = 50441611   

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
A disintegrin and metalloproteinase with thrombospondin motifs 5 (ADAMTS-5) (Homo sapiens (Human))	BDBM50441611 (CHEMBL2437180) Show SMILES O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=S)NCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C29H27N3O3S/c33-28(21-35-27-17-15-26(16-18-27)34-20-23-7-3-1-4-8-23)31-32-29(36)30-19-22-11-13-25(14-12-22)24-9-5-2-6-10-24/h1-18H,19-21H2,(H,31,33)(H2,30,32,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibition of human recombinant ADAMTS-5 using ARGSVILTV-KPIFEVSPSPL(biotinyl)K as substrate incubated 10 mins prior to substrate addition measured a...				Eur J Med Chem 69: 244-61 (2013) Article DOI: 10.1016/j.ejmech.2013.08.027 BindingDB Entry DOI: 10.7270/Q2J967TM
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