BDBM50445419 CHEMBL3104676

SMILES: O=C1CS\C(N1)=C\c1nc-2c(CCc3ccccc-23)s1

InChI Key: InChIKey=HOAVJMYIPJWXKN-NTUHNPAUSA-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 = 50445419   

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))	BDBM50445419 (CHEMBL3104676) Show SMILES O=C1CS\C(N1)=C\c1nc-2c(CCc3ccccc-23)s1 Show InChI InChI=1S/C15H12N2OS2/c18-12-8-19-13(16-12)7-14-17-15-10-4-2-1-3-9(10)5-6-11(15)20-14/h1-4,7H,5-6,8H2,(H,16,18)/b13-7+	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	700	n/a	n/a	n/a	n/a	n/a	n/a
Asahi Kasei Pharma Corporation Curated by ChEMBL					Assay Description Inhibition of human recombinant ADAMTS-5 using interglobular domain peptide of aggrecan after 60 mins by FRET assay				Eur J Med Chem 71: 250-8 (2014) Article DOI: 10.1016/j.ejmech.2013.10.075 BindingDB Entry DOI: 10.7270/Q2F76F15
					More data for this Ligand-Target Pair