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PubMed code 28062195

Compile data set for download or QSAR
Found 8 hits of Enzyme Inhibition Constant Data   
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))
BDBM50209837
PNG
(CHEMBL3885083)
Show SMILES CCCCCCCCCCCCCCCNC(=O)c1ccccc1O
Show InChI InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-23-22(25)20-17-14-15-18-21(20)24/h14-15,17-18,24H,2-13,16,19H2,1H3,(H,23,25)
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PubMed
n/an/a 1.10E+4n/an/an/an/an/an/a



Italy; Universit£ Vita-Salute San Raffaele

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA using PAMCA as substrate preincubated for 30 mins followed by substrate addition measured every 3 mins for 2.5 h...


Bioorg Med Chem 25: 1242-1249 (2017)


Article DOI: 10.1016/j.bmc.2016.12.042
BindingDB Entry DOI: 10.7270/Q29K4D7W
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM50209840
PNG
(CHEMBL3885119)
Show SMILES CCCCCCCCCCCCCCCNC(=O)[C@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C23H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-24-23(26)22(25)21-18-15-14-16-19-21/h14-16,18-19,22,25H,2-13,17,20H2,1H3,(H,24,26)/t22-/m1/s1
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n/an/a 2.00E+4n/an/an/an/an/an/a



Italy; Universit£ Vita-Salute San Raffaele

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA using PAMCA as substrate preincubated for 30 mins followed by substrate addition measured every 3 mins for 2.5 h...


Bioorg Med Chem 25: 1242-1249 (2017)


Article DOI: 10.1016/j.bmc.2016.12.042
BindingDB Entry DOI: 10.7270/Q29K4D7W
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM50171286
PNG
(3-Hydroxy-N-pentadecyl-propionamide | CHEMBL423904...)
Show SMILES CCCCCCCCCCCCCCCNC(=O)CCO
Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-18(21)15-17-20/h20H,2-17H2,1H3,(H,19,21)
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n/an/a 3.40E+4n/an/an/an/an/an/a



Italy; Universit£ Vita-Salute San Raffaele

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA using PAMCA as substrate preincubated for 30 mins followed by substrate addition measured every 3 mins for 2.5 h...


Bioorg Med Chem 25: 1242-1249 (2017)


Article DOI: 10.1016/j.bmc.2016.12.042
BindingDB Entry DOI: 10.7270/Q29K4D7W
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM50209836
PNG
(CHEMBL3885323)
Show SMILES CCCCCCCCCCCCCCCNC(=O)c1cc(O)ccc1O
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-23-22(26)20-18-19(24)15-16-21(20)25/h15-16,18,24-25H,2-14,17H2,1H3,(H,23,26)
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n/an/a 3.80E+4n/an/an/an/an/an/a



Italy; Universit£ Vita-Salute San Raffaele

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA using PAMCA as substrate preincubated for 30 mins followed by substrate addition measured every 3 mins for 2.5 h...


Bioorg Med Chem 25: 1242-1249 (2017)


Article DOI: 10.1016/j.bmc.2016.12.042
BindingDB Entry DOI: 10.7270/Q29K4D7W
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM50309176
PNG
(CHEMBL190429 | N-Pentadecyl-benzamide | N-pentadec...)
Show SMILES CCCCCCCCCCCCCCCNC(=O)c1ccccc1
Show InChI InChI=1S/C22H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-23-22(24)21-18-15-14-16-19-21/h14-16,18-19H,2-13,17,20H2,1H3,(H,23,24)
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n/an/a 4.50E+4n/an/an/an/an/an/a



Italy; Universit£ Vita-Salute San Raffaele

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA using PAMCA as substrate preincubated for 30 mins followed by substrate addition measured every 3 mins for 2.5 h...


Bioorg Med Chem 25: 1242-1249 (2017)


Article DOI: 10.1016/j.bmc.2016.12.042
BindingDB Entry DOI: 10.7270/Q29K4D7W
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM50209839
PNG
(CHEMBL3883768)
Show SMILES CCCCCCCCCCCCCCCNC(=O)[C@@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C23H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-24-23(26)22(25)21-18-15-14-16-19-21/h14-16,18-19,22,25H,2-13,17,20H2,1H3,(H,24,26)/t22-/m0/s1
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n/an/a 7.80E+4n/an/an/an/an/an/a



Italy; Universit£ Vita-Salute San Raffaele

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA using PAMCA as substrate preincubated for 30 mins followed by substrate addition measured every 3 mins for 2.5 h...


Bioorg Med Chem 25: 1242-1249 (2017)


Article DOI: 10.1016/j.bmc.2016.12.042
BindingDB Entry DOI: 10.7270/Q29K4D7W
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM50209838
PNG
(CHEMBL3884680)
Show SMILES CCCCCCCCCCCCCCCNC(=O)c1ccncc1
Show InChI InChI=1S/C21H36N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-23-21(24)20-15-18-22-19-16-20/h15-16,18-19H,2-14,17H2,1H3,(H,23,24)
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n/an/a 9.80E+4n/an/an/an/an/an/a



Italy; Universit£ Vita-Salute San Raffaele

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA using PAMCA as substrate preincubated for 30 mins followed by substrate addition measured every 3 mins for 2.5 h...


Bioorg Med Chem 25: 1242-1249 (2017)


Article DOI: 10.1016/j.bmc.2016.12.042
BindingDB Entry DOI: 10.7270/Q29K4D7W
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM50209841
PNG
(CHEMBL3884760)
Show SMILES CCCCCCCCCCCCCCCNC(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-27-26(28)25-20-19-23-17-14-15-18-24(23)22-25/h14-15,17-20,22H,2-13,16,21H2,1H3,(H,27,28)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Italy; Universit£ Vita-Salute San Raffaele

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA using PAMCA as substrate preincubated for 30 mins followed by substrate addition measured every 3 mins for 2.5 h...


Bioorg Med Chem 25: 1242-1249 (2017)


Article DOI: 10.1016/j.bmc.2016.12.042
BindingDB Entry DOI: 10.7270/Q29K4D7W
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%