BDBM50064113 CHEMBL40168::{[(S)-1-(2-Biphenyl-4-yl-ethylcarbamoyl)-4-(2,4-difluoro-phenyl)-but-3-ynylamino]-methyl}-phosphonic acid

SMILES: OP(O)(=O)CN[C@@H](CC#Cc1ccc(F)cc1F)C(=O)NCCc1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=JWOKQGCIQICHIX-VWLOTQADSA-N

Data: 2 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 2 hits for monomerid = 50064113   

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
Neprilysin (Homo sapiens (Human))	BDBM50064113 (CHEMBL40168 | {[(S)-1-(2-Biphenyl-4-yl-ethylcarbam...) Show SMILES OP(O)(=O)CN[C@@H](CC#Cc1ccc(F)cc1F)C(=O)NCCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C26H25F2N2O4P/c27-23-14-13-22(24(28)17-23)7-4-8-25(30-18-35(32,33)34)26(31)29-16-15-19-9-11-21(12-10-19)20-5-2-1-3-6-20/h1-3,5-6,9-14,17,25,30H,8,15-16,18H2,(H,29,31)(H2,32,33,34)/t25-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharmaceuticals Corporation Curated by ChEMBL					Assay Description Inhibitory activity against neutral endopeptidase (NEP).				J Med Chem 41: 1513-23 (1998) Article DOI: 10.1021/jm970787c BindingDB Entry DOI: 10.7270/Q2PV6M1M
					More data for this Ligand-Target Pair
Endothelin-converting enzyme 1 (ECE1) (Homo sapiens (Human))	BDBM50064113 (CHEMBL40168 | {[(S)-1-(2-Biphenyl-4-yl-ethylcarbam...) Show SMILES OP(O)(=O)CN[C@@H](CC#Cc1ccc(F)cc1F)C(=O)NCCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C26H25F2N2O4P/c27-23-14-13-22(24(28)17-23)7-4-8-25(30-18-35(32,33)34)26(31)29-16-15-19-9-11-21(12-10-19)20-5-2-1-3-6-20/h1-3,5-6,9-14,17,25,30H,8,15-16,18H2,(H,29,31)(H2,32,33,34)/t25-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharmaceuticals Corporation Curated by ChEMBL					Assay Description Inhibitory activity was assessed on CHO cells expressing recombinant human Endothelin-converting enzyme 1 (ECE-1).				J Med Chem 41: 1513-23 (1998) Article DOI: 10.1021/jm970787c BindingDB Entry DOI: 10.7270/Q2PV6M1M
					More data for this Ligand-Target Pair