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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 = 'BDBM50450753'   
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


(Rattus norvegicus (Rat))
BDBM50450753
PNG
(CHEMBL4207570)
Show SMILES O=C(CCc1ccc(cc1)-c1ccccc1)N1CCCC1
Show InChI InChI=1S/C19H21NO/c21-19(20-14-4-5-15-20)13-10-16-8-11-18(12-9-16)17-6-2-1-3-7-17/h1-3,6-9,11-12H,4-5,10,13-15H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.12E+3n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of rat NAAA expressed in HEK293 cells by LC/MS analysis


J Med Chem 60: 4-46 (2017)


Article DOI: 10.1021/acs.jmedchem.6b00538
BindingDB Entry DOI: 10.7270/Q2348NZC
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM50450753
PNG
(CHEMBL4207570)
Show SMILES O=C(CCc1ccc(cc1)-c1ccccc1)N1CCCC1
Show InChI InChI=1S/C19H21NO/c21-19(20-14-4-5-15-20)13-10-16-8-11-18(12-9-16)17-6-2-1-3-7-17/h1-3,6-9,11-12H,4-5,10,13-15H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.10E+3n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of NAAA (unknown origin)


J Med Chem 63: 7475-7490 (2020)


Article DOI: 10.1021/acs.jmedchem.0c00191
BindingDB Entry DOI: 10.7270/Q2V98CM4
More data for this
Ligand-Target Pair