Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Interstitial collagenase' and Ligand = 'BDBM50076339'   

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
Interstitial collagenase (Homo sapiens (Human))	BDBM50076339 ((S)-3-(4-Hydroxy-phenyl)-N-methyl-2-[3-(5-thioxo-4...) Show SMILES CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Nc1nnc(S)s1 Show InChI InChI=1S/C13H15N5O3S2/c1-14-10(20)9(6-7-2-4-8(19)5-3-7)15-11(21)16-12-17-18-13(22)23-12/h2-5,9,19H,6H2,1H3,(H,14,20)(H,18,22)(H2,15,16,17,21)/t9-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia and Upjohn Curated by ChEMBL					Assay Description Binding affinity for matrix metalloproteinase-1				J Med Chem 42: 1525-36 (1999) Article DOI: 10.1021/jm9803222 BindingDB Entry DOI: 10.7270/Q2C828G4
					More data for this Ligand-Target Pair