Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Angiotensin-converting enzyme' and Ligand = 'BDBM50182328'   

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
Angiotensin-converting enzyme (Homo sapiens (Human))	BDBM50182328 (CHEMBL378864 | MTP-Orn-Pro) Show SMILES CN[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCN)C(=O)N1CCC[C@H]1C(O)=O Show InChI InChI=1S/C22H31N5O4/c1-24-18(12-14-13-25-16-7-3-2-6-15(14)16)20(28)26-17(8-4-10-23)21(29)27-11-5-9-19(27)22(30)31/h2-3,6-7,13,17-19,24-25H,4-5,8-12,23H2,1H3,(H,26,28)(H,30,31)/t17-,18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Genomics and Integrative Biology Curated by ChEMBL					Assay Description Inhibition of ACE in bovine kidney				Bioorg Med Chem Lett 16: 2117-21 (2006) Article DOI: 10.1016/j.bmcl.2006.01.061 BindingDB Entry DOI: 10.7270/Q2DB81DM
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