BDBM50022012 Ac-His-Pro-Phe-His-Statine-tLeu-Phe-NH2::CHEMBL404799

SMILES: CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(C)=O)[C@@H](O)CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(C)(C)C

InChI Key: InChIKey=YIRJFMWHEYQHJJ-XHXCLNLRSA-N

Data: 1 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 1 hit for monomerid = 50022012   

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 (Rattus norvegicus)	BDBM50022012 (Ac-His-Pro-Phe-His-Statine-tLeu-Phe-NH2 | CHEMBL40...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(C)=O)[C@@H](O)CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(C)(C)C Show InChI InChI=1S/C51H70N12O9/c1-30(2)20-36(42(65)25-43(66)62-44(51(4,5)6)49(71)59-37(45(52)67)21-32-14-9-7-10-15-32)58-47(69)39(23-34-26-53-28-55-34)60-46(68)38(22-33-16-11-8-12-17-33)61-48(70)41-18-13-19-63(41)50(72)40(57-31(3)64)24-35-27-54-29-56-35/h7-12,14-17,26-30,36-42,44,65H,13,18-25H2,1-6H3,(H2,52,67)(H,53,55)(H,54,56)(H,57,64)(H,58,69)(H,59,71)(H,60,68)(H,61,70)(H,62,66)/t36-,37-,38-,39-,40-,41+,42-,44+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibitory activity against rat plasma renin in vitro.				J Med Chem 31: 1679-86 (1988) BindingDB Entry DOI: 10.7270/Q2NC61TR
					More data for this Ligand-Target Pair