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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50064112   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Endothelin-converting enzyme 1


(Homo sapiens (Human))
BDBM50064112
PNG
((S)-5-(2-Fluoro-phenyl)-2-[(S)-5-(2-fluoro-phenyl)...)
Show SMILES OC(=O)[C@H](CC#Cc1ccccc1F)NC(=O)[C@H](CC#Cc1ccccc1F)NCP(O)(O)=O
Show InChI InChI=1S/C23H21F2N2O6P/c24-18-11-3-1-7-16(18)9-5-13-20(26-15-34(31,32)33)22(28)27-21(23(29)30)14-6-10-17-8-2-4-12-19(17)25/h1-4,7-8,11-12,20-21,26H,13-15H2,(H,27,28)(H,29,30)(H2,31,32,33)/t20-,21-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 28n/an/an/an/an/an/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
Neprilysin


(Homo sapiens (Human))
BDBM50064112
PNG
((S)-5-(2-Fluoro-phenyl)-2-[(S)-5-(2-fluoro-phenyl)...)
Show SMILES OC(=O)[C@H](CC#Cc1ccccc1F)NC(=O)[C@H](CC#Cc1ccccc1F)NCP(O)(O)=O
Show InChI InChI=1S/C23H21F2N2O6P/c24-18-11-3-1-7-16(18)9-5-13-20(26-15-34(31,32)33)22(28)27-21(23(29)30)14-6-10-17-8-2-4-12-19(17)25/h1-4,7-8,11-12,20-21,26H,13-15H2,(H,27,28)(H,29,30)(H2,31,32,33)/t20-,21-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.30E+3n/an/an/an/an/an/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