Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 508.5 BDBM50173082

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Renin (Homo sapiens (Human))	BDBM50173082 ((R)-6-(4-Fluoro-benzyloxymethyl)-1-{4-[3-(2-methox...) Show SMILES COc1ccccc1COCCCOc1ccc(cc1)N1[C@@H](COCc2ccc(F)cc2)CNCC1=O Show InChI InChI=1S/C29H33FN2O5/c1-34-28-6-3-2-5-23(28)20-35-15-4-16-37-27-13-11-25(12-14-27)32-26(17-31-18-29(32)33)21-36-19-22-7-9-24(30)10-8-22/h2-3,5-14,26,31H,4,15-21H2,1H3/t26-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against renin in fluorescent tGFP assay				Bioorg Med Chem Lett 15: 4713-6 (2005) Article DOI: 10.1016/j.bmcl.2005.07.063 BindingDB Entry DOI: 10.7270/Q2SF2VP9
					More data for this Ligand-Target Pair