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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'N-acylethanolamine-hydrolyzing acid amidase' and Ligand = 'BDBM430302'   
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
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM430302
PNG
(US10556892, Compound 42)
Show SMILES C[C@H]1CN(CCN1C(=O)c1ccccc1S(=O)(=O)C1CC1)c1nc2ccc(F)cc2s1 |r|
Show InChI InChI=1S/C22H22FN3O3S2/c1-14-13-25(22-24-18-9-6-15(23)12-19(18)30-22)10-11-26(14)21(27)17-4-2-3-5-20(17)31(28,29)16-7-8-16/h2-6,9,12,14,16H,7-8,10-11,13H2,1H3/t14-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 180n/an/an/an/an/an/a



The Regents of the University of California; Fondazione Istituto Italiano di Technologia

US Patent


Assay Description
HEK293 cells stably transfected with the human NAAA coding sequence cloned from a human spleen cDNA library (catalog no. 639124, Clontech, Mountain V...


US Patent US10556892 (2020)


BindingDB Entry DOI: 10.7270/Q2V40XM0
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM430302
PNG
(US10556892, Compound 42)
Show SMILES C[C@H]1CN(CCN1C(=O)c1ccccc1S(=O)(=O)C1CC1)c1nc2ccc(F)cc2s1 |r|
Show InChI InChI=1S/C22H22FN3O3S2/c1-14-13-25(22-24-18-9-6-15(23)12-19(18)30-22)10-11-26(14)21(27)17-4-2-3-5-20(17)31(28,29)16-7-8-16/h2-6,9,12,14,16H,7-8,10-11,13H2,1H3/t14-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 314n/an/an/an/an/an/a



The Regents of the University of California; Fondazione Istituto Italiano di Technologia

US Patent


Assay Description
HEK293 cells stably transfected with the human NAAA coding sequence cloned from a human spleen cDNA library (catalog no. 639124, Clontech, Mountain V...


US Patent US10556892 (2020)


BindingDB Entry DOI: 10.7270/Q2V40XM0
More data for this
Ligand-Target Pair