Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 425.5 BDBM50171617

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
Endothelin-converting enzyme 1 (Homo sapiens (Human))	BDBM50171617 (5-(3,3-Dimethyl-butyrylamino)-1-phenyl-1H-indole-2...) Show SMILES CC(C)(C)CC(=O)Nc1ccc2n(c(cc2c1)C(=O)Nc1ccccc1)-c1ccccc1 Show InChI InChI=1S/C27H27N3O2/c1-27(2,3)18-25(31)28-21-14-15-23-19(16-21)17-24(30(23)22-12-8-5-9-13-22)26(32)29-20-10-6-4-7-11-20/h4-17H,18H2,1-3H3,(H,28,31)(H,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
BAYER HealthCare AG Curated by ChEMBL					Assay Description Inhibitory concentration against endothelin converting enzyme 1 using bradykinin-derived substrate				Bioorg Med Chem Lett 15: 4201-5 (2005) Article DOI: 10.1016/j.bmcl.2005.06.085 BindingDB Entry DOI: 10.7270/Q2H994R9
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