Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '72 kDa type IV collagenase' and Ligand = 'BDBM50131661'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50131661 (CHEMBL116944 | N-(3-Hydroxycarbamoyl-1-hydroxymeth...) Show SMILES C[C@@H](C[C@@H](CO)NC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO Show InChI InChI=1S/C19H22N2O5/c1-13(18(23)21-25)11-15(12-22)20-19(24)14-7-9-17(10-8-14)26-16-5-3-2-4-6-16/h2-10,13,15,22,25H,11-12H2,1H3,(H,20,24)(H,21,23)/t13-,15-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	0.650	n/a	n/a	n/a	n/a	n/a	n/a
National Cardiovascular Center Research Institute Curated by ChEMBL					Assay Description Inhibition of human Matrix metalloprotease-2 (MMP-2)				J Med Chem 46: 3497-501 (2003) Article DOI: 10.1021/jm020356g BindingDB Entry DOI: 10.7270/Q2862FT2
					More data for this Ligand-Target Pair