null

SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C

InChI Key: InChIKey=WOTVFZVYVNFVGQ-AGKYWFPGSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50407080   

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))	BDBM50407080 (CHEMBL2112254) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C38H59N3O6/c1-8-25(4)33(41-35(44)31(22-26-14-10-9-11-15-26)40-37(46)47-38(5,6)7)36(45)39-30(34(43)32(42)20-24(2)3)23-27-18-19-28-16-12-13-17-29(28)21-27/h12-13,16-19,21,24-26,30-34,42-43H,8-11,14-15,20,22-23H2,1-7H3,(H,39,45)(H,40,46)(H,41,44)/t25-,30-,31-,32-,33-,34+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibition of partially purified human renin at pH 6.0.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Endothelin-converting enzyme 1 (Rattus norvegicus (Rat))	BDBM50407080 (CHEMBL2112254) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C38H59N3O6/c1-8-25(4)33(41-35(44)31(22-26-14-10-9-11-15-26)40-37(46)47-38(5,6)7)36(45)39-30(34(43)32(42)20-24(2)3)23-27-18-19-28-16-12-13-17-29(28)21-27/h12-13,16-19,21,24-26,30-34,42-43H,8-11,14-15,20,22-23H2,1-7H3,(H,39,45)(H,40,46)(H,41,44)/t25-,30-,31-,32-,33-,34+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of big endothelial-1 (Big ET-1) to ET-1 by endothelin converting enzyme(ECE) in rat lung membrane.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair
Cathepsin D (Bos taurus)	BDBM50407080 (CHEMBL2112254) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C38H59N3O6/c1-8-25(4)33(41-35(44)31(22-26-14-10-9-11-15-26)40-37(46)47-38(5,6)7)36(45)39-30(34(43)32(42)20-24(2)3)23-27-18-19-28-16-12-13-17-29(28)21-27/h12-13,16-19,21,24-26,30-34,42-43H,8-11,14-15,20,22-23H2,1-7H3,(H,39,45)(H,40,46)(H,41,44)/t25-,30-,31-,32-,33-,34+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of conversion of hemoglobin by commercially purchased bovine spleen cathepsin D.				J Med Chem 36: 468-78 (1993) BindingDB Entry DOI: 10.7270/Q2PC331F
					More data for this Ligand-Target Pair