BDBM50328866 CHEMBL1270761::rac-N-cyclopropyl-4-(4-(2-(2,6-dichloro-4-methylphenoxy)ethoxy)phenyl)-N-(2,3-dimethylbenzyl)-4-hydroxypiperidine-3-carboxamide

SMILES: Cc1cc(Cl)c(OCCOc2ccc(cc2)C2(O)CCNCC2C(=O)N(Cc2cccc(C)c2C)C2CC2)c(Cl)c1

InChI Key: InChIKey=BUELDWWCLYPLID-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50328866   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Renin (Homo sapiens (Human))	BDBM50328866 (CHEMBL1270761 | rac-N-cyclopropyl-4-(4-(2-(2,6-dic...) Show SMILES Cc1cc(Cl)c(OCCOc2ccc(cc2)C2(O)CCNCC2C(=O)N(Cc2cccc(C)c2C)C2CC2)c(Cl)c1 Show InChI InChI=1S/C33H38Cl2N2O4/c1-21-17-29(34)31(30(35)18-21)41-16-15-40-27-11-7-25(8-12-27)33(39)13-14-36-19-28(33)32(38)37(26-9-10-26)20-24-6-4-5-22(2)23(24)3/h4-8,11-12,17-18,26,28,36,39H,9-10,13-16,19-20H2,1-3H3	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	0.180	n/a	n/a	n/a	n/a	n/a	n/a
Actelion Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Inhibition of renin in buffer				Bioorg Med Chem Lett 20: 6286-90 (2010) Article DOI: 10.1016/j.bmcl.2010.08.086 BindingDB Entry DOI: 10.7270/Q2WD40T3
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50328866 (CHEMBL1270761 | rac-N-cyclopropyl-4-(4-(2-(2,6-dic...) Show SMILES Cc1cc(Cl)c(OCCOc2ccc(cc2)C2(O)CCNCC2C(=O)N(Cc2cccc(C)c2C)C2CC2)c(Cl)c1 Show InChI InChI=1S/C33H38Cl2N2O4/c1-21-17-29(34)31(30(35)18-21)41-16-15-40-27-11-7-25(8-12-27)33(39)13-14-36-19-28(33)32(38)37(26-9-10-26)20-24-6-4-5-22(2)23(24)3/h4-8,11-12,17-18,26,28,36,39H,9-10,13-16,19-20H2,1-3H3	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	45	n/a	n/a	n/a	n/a	n/a	n/a
Actelion Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Inhibition of renin in plasma				Bioorg Med Chem Lett 20: 6286-90 (2010) Article DOI: 10.1016/j.bmcl.2010.08.086 BindingDB Entry DOI: 10.7270/Q2WD40T3
					More data for this Ligand-Target Pair