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BDBM50084898 2-[3-Dibenzofuran-3-yl-2-(phosphonomethyl-amino)-propionylamino]-4-methyl-pentanoic acid::CHEMBL357226

SMILES: CC(C)CC(NC(=O)[C@H](Cc1ccc2c(c1)oc1ccccc21)NCP(O)(O)=O)C(O)=O

InChI Key: InChIKey=UGKGUEDVMKIJFU-ZENAZSQFSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50084898   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Endothelin-converting enzyme 1 (ECE1)


(Homo sapiens (Human))
BDBM50084898
PNG
(2-[3-Dibenzofuran-3-yl-2-(phosphonomethyl-amino)-p...)
Show SMILES CC(C)CC(NC(=O)[C@H](Cc1ccc2c(c1)oc1ccccc21)NCP(O)(O)=O)C(O)=O
Show InChI InChI=1S/C22H27N2O7P/c1-13(2)9-18(22(26)27)24-21(25)17(23-12-32(28,29)30)10-14-7-8-16-15-5-3-4-6-19(15)31-20(16)11-14/h3-8,11,13,17-18,23H,9-10,12H2,1-2H3,(H,24,25)(H,26,27)(H2,28,29,30)/t17-,18?/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 13n/an/an/an/an/an/a



Novartis Institute for Biomedical Research

Curated by ChEMBL


Assay Description
In Vitro inhibition of recombinant human endothelin converting enzyme-1


J Med Chem 43: 488-504 (2000)


BindingDB Entry DOI: 10.7270/Q21G0MZR
More data for this
Ligand-Target Pair
Neutral Endopeptidase (NEP)


(Rattus norvegicus (Rat))
BDBM50084898
PNG
(2-[3-Dibenzofuran-3-yl-2-(phosphonomethyl-amino)-p...)
Show SMILES CC(C)CC(NC(=O)[C@H](Cc1ccc2c(c1)oc1ccccc21)NCP(O)(O)=O)C(O)=O
Show InChI InChI=1S/C22H27N2O7P/c1-13(2)9-18(22(26)27)24-21(25)17(23-12-32(28,29)30)10-14-7-8-16-15-5-3-4-6-19(15)31-20(16)11-14/h3-8,11,13,17-18,23H,9-10,12H2,1-2H3,(H,24,25)(H,26,27)(H2,28,29,30)/t17-,18?/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 31n/an/an/an/an/an/a



Novartis Institute for Biomedical Research

Curated by ChEMBL


Assay Description
In vitro inhibition of rat neutral endopeptidase


J Med Chem 43: 488-504 (2000)


BindingDB Entry DOI: 10.7270/Q21G0MZR
More data for this
Ligand-Target Pair