Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 873.9 BDBM50287105

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))	BDBM50287105 ((S)-2-(2-{[1-((S)-6-Benzyloxycarbonylamino-2-metha...) Show SMILES CC(C)C(CP(O)([O-])=C(Cc1ccc2ccccc2c1)NC(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NS(C)(=O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C([O-])=O Show InChI InChI=1S/C44H53N5O10PS/c1-29(2)36(41(50)47-39(43(52)53)25-34-26-46-37-18-10-9-17-35(34)37)28-60(55,56)40(24-31-20-21-32-15-7-8-16-33(32)23-31)48-42(51)38(49-61(3,57)58)19-11-12-22-45-44(54)59-27-30-13-5-4-6-14-30/h4-10,13-18,20-21,23,26,29,36,38-39,46,49H,11-12,19,22,24-25,27-28H2,1-3H3,(H5-,45,47,48,50,51,52,53,54,55,56)/q-1/p-1/t36?,38-,39-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of Endothelin-converting enzyme of guinea pig lung membrane				Bioorg Med Chem Lett 6: 1257-1260 (1996) Article DOI: 10.1016/0960-894X(96)00211-9 BindingDB Entry DOI: 10.7270/Q2ZS2X1M
					More data for this Ligand-Target Pair