Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Suppressor of tumorigenicity 14 protein' and Ligand = 'BDBM50017943'   

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
Suppressor of tumorigenicity 14 protein (Homo sapiens (Human))	BDBM50017943 (CHEMBL3289300) Show SMILES N[C@H]1CC[C@@H](CC1)NC(=O)c1cc(OCc2ccc(cc2)C(N)=N)cc(OCc2ccc(cc2)C(N)=N)c1 |r,wU:4.7,wD:1.0,(-.89,-7.94,;.65,-7.94,;1.42,-9.27,;2.96,-9.27,;3.73,-7.94,;2.96,-6.61,;1.42,-6.61,;5.27,-7.94,;6.04,-6.61,;5.27,-5.27,;7.58,-6.61,;8.35,-7.94,;9.89,-7.94,;10.66,-9.27,;12.2,-9.27,;12.97,-10.61,;14.51,-10.61,;15.28,-11.94,;14.51,-13.27,;12.97,-13.27,;12.2,-11.94,;15.28,-14.61,;14.51,-15.94,;16.82,-14.61,;10.66,-6.61,;9.89,-5.27,;10.66,-3.94,;12.2,-3.94,;12.97,-2.6,;12.2,-1.27,;12.97,.06,;14.51,.06,;15.28,-1.27,;14.51,-2.6,;15.28,1.4,;16.82,1.4,;14.51,2.73,;8.35,-5.27,)| Show InChI InChI=1S/C29H34N6O3/c30-23-9-11-24(12-10-23)35-29(36)22-13-25(37-16-18-1-5-20(6-2-18)27(31)32)15-26(14-22)38-17-19-3-7-21(8-4-19)28(33)34/h1-8,13-15,23-24H,9-12,16-17,30H2,(H3,31,32)(H3,33,34)(H,35,36)/t23-,24-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Aurigene Discovery Technologies Limited Curated by ChEMBL					Assay Description Inhibition of recombinant matriptase (unknown origin) using Boc-Gln-Ala-Arg-7-amido-4-methyl coumarin hydrobromide				Bioorg Med Chem 22: 3187-203 (2014) Article DOI: 10.1016/j.bmc.2014.04.013 BindingDB Entry DOI: 10.7270/Q2J967ZD
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