Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '72 kDa type IV collagenase' and Ligand = 'BDBM50290164'   

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))	BDBM50290164 ((R)-3-[(S)-2-(4-Methoxy-phenyl)-1-methylcarbamoyl-...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)CC(O)=O Show InChI InChI=1S/C19H28N2O5/c1-12(2)9-14(11-17(22)23)18(24)21-16(19(25)20-3)10-13-5-7-15(26-4)8-6-13/h5-8,12,14,16H,9-11H2,1-4H3,(H,20,25)(H,21,24)(H,22,23)/t14-,16+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of Matrix metalloproteinase-2 (MMP-2)				Bioorg Med Chem Lett 7: 2331-2336 (1997) Article DOI: 10.1016/S0960-894X(97)00182-0 BindingDB Entry DOI: 10.7270/Q2TH8MQ4
					More data for this Ligand-Target Pair