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BDBM50439650 CHEMBL2419807

SMILES: CC(C)C(CCCCc1ccccc1)OC(=O)N[C@@H]1[C@H](C)OC1=O

InChI Key: InChIKey=AQONVGWZCJECDU-DRXWIORDSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50439650   
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
N-acylethanolamine-hydrolyzing acid amidase (NAAA)


(Rattus norvegicus (Rat))
BDBM50439650
PNG
(CHEMBL2419807)
Show SMILES CC(C)C(CCCCc1ccccc1)OC(=O)N[C@@H]1[C@H](C)OC1=O |r|
Show InChI InChI=1S/C19H27NO4/c1-13(2)16(12-8-7-11-15-9-5-4-6-10-15)24-19(22)20-17-14(3)23-18(17)21/h4-6,9-10,13-14,16-17H,7-8,11-12H2,1-3H3,(H,20,22)/t14-,16?,17+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Istituto Italiano di Tecnologia

Curated by ChEMBL


Assay Description
Inhibition of Sprague Dawley rat lung native NAAA enzyme using heptadecenoylethanolamide as substrate preincubated for 30 mins followed by substrate ...


J Med Chem 56: 6917-34 (2013)


Article DOI: 10.1021/jm400739u
BindingDB Entry DOI: 10.7270/Q2F47QK0
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase (NAAA)


(Rattus norvegicus (Rat))
BDBM50439650
PNG
(CHEMBL2419807)
Show SMILES CC(C)C(CCCCc1ccccc1)OC(=O)N[C@@H]1[C@H](C)OC1=O |r|
Show InChI InChI=1S/C19H27NO4/c1-13(2)16(12-8-7-11-15-9-5-4-6-10-15)24-19(22)20-17-14(3)23-18(17)21/h4-6,9-10,13-14,16-17H,7-8,11-12H2,1-3H3,(H,20,22)/t14-,16?,17+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 80n/an/an/an/an/an/a



Istituto Italiano di Tecnologia

Curated by ChEMBL


Assay Description
Inhibition of Sprague Dawley rat lung native NAAA enzyme using heptadecenoylethanolamide as substrate preincubated for 30 mins followed by substrate ...


J Med Chem 56: 6917-34 (2013)


Article DOI: 10.1021/jm400739u
BindingDB Entry DOI: 10.7270/Q2F47QK0
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase (NAAA)


(Rattus norvegicus (Rat))
BDBM50439650
PNG
(CHEMBL2419807)
Show SMILES CC(C)C(CCCCc1ccccc1)OC(=O)N[C@@H]1[C@H](C)OC1=O |r|
Show InChI InChI=1S/C19H27NO4/c1-13(2)16(12-8-7-11-15-9-5-4-6-10-15)24-19(22)20-17-14(3)23-18(17)21/h4-6,9-10,13-14,16-17H,7-8,11-12H2,1-3H3,(H,20,22)/t14-,16?,17+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.22E+4n/an/an/an/an/an/a



Istituto Italiano di Tecnologia

Curated by ChEMBL


Assay Description
Inhibition of Sprague Dawley rat lung native NAAA enzyme using heptadecenoylethanolamide as substrate preincubated for 30 mins followed by substrate ...


J Med Chem 56: 6917-34 (2013)


Article DOI: 10.1021/jm400739u
BindingDB Entry DOI: 10.7270/Q2F47QK0
More data for this
Ligand-Target Pair