Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carboxypeptidase B' and Ligand = 'BDBM50201439'   

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
Carboxypeptidase B (Sus scrofa)	BDBM50201439 (2-(2-chloro-5-guanidinophenyl)-3-mercaptopropanoic...) Show SMILES [#7]\[#6](-[#7])=[#7]\c1ccc(Cl)c(c1)-[#6](-[#6]-[#16])-[#6](-[#8])=O Show InChI InChI=1S/C10H12ClN3O2S/c11-8-2-1-5(14-10(12)13)3-6(8)7(4-17)9(15)16/h1-3,7,17H,4H2,(H,15,16)(H4,12,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic carboxypeptidase B				Bioorg Med Chem Lett 17: 1349-54 (2007) Article DOI: 10.1016/j.bmcl.2006.11.078 BindingDB Entry DOI: 10.7270/Q2RJ4J5B
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