Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Interstitial collagenase' and Ligand = 'BDBM50064343'   

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))	BDBM50064343 ((3S,5R,13S)-13-Methylcarbamoyl-2,7-dioxo-3-pheneth...) Show SMILES CNC(=O)[C@@H]1CCCCNC(=O)C[C@@H](N[C@@H](CCc2ccccc2)C(=O)N1)C(O)=O Show InChI InChI=1S/C21H30N4O5/c1-22-19(27)15-9-5-6-12-23-18(26)13-17(21(29)30)24-16(20(28)25-15)11-10-14-7-3-2-4-8-14/h2-4,7-8,15-17,24H,5-6,9-13H2,1H3,(H,22,27)(H,23,26)(H,25,28)(H,29,30)/t15-,16-,17+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The DuPont Merck Pharmaceutical Co. Curated by ChEMBL					Assay Description Inhibition of Matrix metalloproteinase-1				J Med Chem 41: 1749-51 (1998) Article DOI: 10.1021/jm970850y BindingDB Entry DOI: 10.7270/Q2BK1BFX
					More data for this Ligand-Target Pair