null

SMILES: COCCCOc1cc(ccc1OC)C(=O)N(C[C@@H]1CNC[C@H]1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(C)C

InChI Key: InChIKey=ZSIZAIHOOZKGLK-ABYGYWHVSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50066150   

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))	BDBM50066150 (CHEMBL3401537) Show SMILES COCCCOc1cc(ccc1OC)C(=O)N(C[C@@H]1CNC[C@H]1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(C)C |r| Show InChI InChI=1S/C32H41N3O7S/c1-23(2)35(32(36)24-11-16-30(40-4)31(19-24)41-18-8-17-39-3)22-25-20-33-21-29(25)34-43(37,38)28-14-12-27(13-15-28)42-26-9-6-5-7-10-26/h5-7,9-16,19,23,25,29,33-34H,8,17-18,20-22H2,1-4H3/t25-,29+/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	880	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharma AG Curated by ChEMBL					Assay Description Inhibition of recombinant human renin by fluorescence based FRET assay in presence of plasma				Bioorg Med Chem Lett 25: 1782-6 (2015) Article DOI: 10.1016/j.bmcl.2015.02.039 BindingDB Entry DOI: 10.7270/Q2Z039TX
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50066150 (CHEMBL3401537) Show SMILES COCCCOc1cc(ccc1OC)C(=O)N(C[C@@H]1CNC[C@H]1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(C)C |r| Show InChI InChI=1S/C32H41N3O7S/c1-23(2)35(32(36)24-11-16-30(40-4)31(19-24)41-18-8-17-39-3)22-25-20-33-21-29(25)34-43(37,38)28-14-12-27(13-15-28)42-26-9-6-5-7-10-26/h5-7,9-16,19,23,25,29,33-34H,8,17-18,20-22H2,1-4H3/t25-,29+/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	8	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharma AG Curated by ChEMBL					Assay Description Inhibition of recombinant human renin by fluorescence based FRET assay				Bioorg Med Chem Lett 25: 1782-6 (2015) Article DOI: 10.1016/j.bmcl.2015.02.039 BindingDB Entry DOI: 10.7270/Q2Z039TX
					More data for this Ligand-Target Pair