BDBM149461 US8975252, 4

SMILES: COCCCOc1cc(CN(C2CC2)C(=O)[C@H]2CNCCO2)cc2ccccc12

InChI Key: InChIKey=PXKWFPHRFQPVMA-JOCHJYFZSA-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 = 149461   

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))	BDBM149461 (US8975252, 4) Show SMILES COCCCOc1cc(CN(C2CC2)C(=O)[C@H]2CNCCO2)cc2ccccc12 |r| Show InChI InChI=1S/C23H30N2O4/c1-27-10-4-11-28-21-14-17(13-18-5-2-3-6-20(18)21)16-25(19-7-8-19)23(26)22-15-24-9-12-29-22/h2-3,5-6,13-14,19,22,24H,4,7-12,15-16H2,1H3/t22-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	30.2	n/a	n/a	n/a	n/a	n/a	37
Shanghai Pharmaceuticals Holding Co., Ltd.; Mitsubishi Tanabe Pharma Corporation US Patent					Assay Description A renin substrate of synthetic peptide (Nma-KHPFH LVIHK(Dnp)-NH2) and test compound were mixed, and fluorescence intensity was assayed using a fluoro...				US Patent US8975252 (2015) BindingDB Entry DOI: 10.7270/Q2TB15NG
					More data for this Ligand-Target Pair