Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 474.4 BDBM459254

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
Neprilysin (Homo sapiens (Human))	BDBM459254 (US10759813, Example 12-8) Show SMILES O[C@H](C[C@@H](Cc1ccc(cc1)-c1ccccc1)NC(=O)c1cc(no1)-c1cccc(F)c1)C(O)=O Show InChI InChI=1S/C27H23FN2O5/c28-21-8-4-7-20(14-21)23-16-25(35-30-23)26(32)29-22(15-24(31)27(33)34)13-17-9-11-19(12-10-17)18-5-2-1-3-6-18/h1-12,14,16,22,24,31H,13,15H2,(H,29,32)(H,33,34)/t22-,24-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	<1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Theravance Biopharma R&D IP, LLC US Patent					Assay Description The assays were performed in 384-well white opaque plates at 37° C. using the fluorogenic peptide substrates at a concentration of 10 μM in Assa...				US Patent US10759813 (2020) BindingDB Entry DOI: 10.7270/Q2XW4NW0
					More data for this Ligand-Target Pair