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PubMed code 26866968

Compile data set for download or QSAR
Found 59 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))		BDBM50151154
PNG
(CHEMBL3770896)
Show SMILES CCCCc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C15H20N2O3/c1-2-3-4-11-5-7-12(8-6-11)10-20-15(19)17-13-9-16-14(13)18/h5-8,13H,2-4,9-10H2,1H3,(H,16,18)(H,17,19)/t13-/m0/s1
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n/an/a 7n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA expressed in HEK293 cells after 30 mins by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151242
PNG
(CHEMBL3770525)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc(cc1)C1CCCCC1 |r|
Show InChI InChI=1S/C17H22N2O3/c20-16-15(10-18-16)19-17(21)22-11-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h6-9,13,15H,1-5,10-11H2,(H,18,20)(H,19,21)/t15-/m0/s1
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n/an/a 12n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA expressed in HEK293 cells after 30 mins by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151055
PNG
(CHEMBL3771111)
Show SMILES CCc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C13H16N2O3/c1-2-9-3-5-10(6-4-9)8-18-13(17)15-11-7-14-12(11)16/h3-6,11H,2,7-8H2,1H3,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 22n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA expressed in HEK293 cells after 30 mins by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151154
PNG
(CHEMBL3770896)
Show SMILES CCCCc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C15H20N2O3/c1-2-3-4-11-5-7-12(8-6-11)10-20-15(19)17-13-9-16-14(13)18/h5-8,13H,2-4,9-10H2,1H3,(H,16,18)(H,17,19)/t13-/m0/s1
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n/an/a 23n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151057
PNG
(CHEMBL3770726)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C14H24N2O3/c17-13-12(10-15-13)16-14(18)19-9-5-4-8-11-6-2-1-3-7-11/h11-12H,1-10H2,(H,15,17)(H,16,18)/t12-/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA expressed in HEK293 cells after 30 mins by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151155
PNG
(CHEMBL3769844)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCC1CCCC1 |r|
Show InChI InChI=1S/C13H22N2O3/c16-12-11(9-14-12)15-13(17)18-8-4-3-7-10-5-1-2-6-10/h10-11H,1-9H2,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 33n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151240
PNG
(CHEMBL3770558)
Show SMILES CCCCCCCCOC(=O)N[C@H]1CNC1=O |r|
Show InChI InChI=1S/C12H22N2O3/c1-2-3-4-5-6-7-8-17-12(16)14-10-9-13-11(10)15/h10H,2-9H2,1H3,(H,13,15)(H,14,16)/t10-/m0/s1
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n/an/a 37n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151242
PNG
(CHEMBL3770525)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc(cc1)C1CCCCC1 |r|
Show InChI InChI=1S/C17H22N2O3/c20-16-15(10-18-16)19-17(21)22-11-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h6-9,13,15H,1-5,10-11H2,(H,18,20)(H,19,21)/t15-/m0/s1
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n/an/a 41n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151239
PNG
(CHEMBL3769455)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCC1CCCCC1 |r|
Show InChI InChI=1S/C13H22N2O3/c16-12-11(9-14-12)15-13(17)18-8-4-7-10-5-2-1-3-6-10/h10-11H,1-9H2,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 44n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151096
PNG
(CHEMBL3769689)
Show SMILES CCCOc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C14H18N2O4/c1-2-7-19-11-5-3-10(4-6-11)9-20-14(18)16-12-8-15-13(12)17/h3-6,12H,2,7-9H2,1H3,(H,15,17)(H,16,18)/t12-/m0/s1
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n/an/a 48n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA expressed in HEK293 cells after 30 mins by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151234
PNG
(CHEMBL3770490)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C15H26N2O3/c18-14-13(11-16-14)17-15(19)20-10-6-2-5-9-12-7-3-1-4-8-12/h12-13H,1-11H2,(H,16,18)(H,17,19)/t13-/m0/s1
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n/an/a 49n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151237
PNG
(CHEMBL3770240)
Show SMILES CCCc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C14H18N2O3/c1-2-3-10-4-6-11(7-5-10)9-19-14(18)16-12-8-15-13(12)17/h4-7,12H,2-3,8-9H2,1H3,(H,15,17)(H,16,18)/t12-/m0/s1
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n/an/a 52n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151232
PNG
(CHEMBL3769763)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCC1CCOCC1 |r|
Show InChI InChI=1S/C13H22N2O4/c16-12-11(9-14-12)15-13(17)19-6-2-1-3-10-4-7-18-8-5-10/h10-11H,1-9H2,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 71n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151057
PNG
(CHEMBL3770726)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C14H24N2O3/c17-13-12(10-15-13)16-14(18)19-9-5-4-8-11-6-2-1-3-7-11/h11-12H,1-10H2,(H,15,17)(H,16,18)/t12-/m0/s1
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n/an/a 73n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human BRD4 bromodomain1 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151149
PNG
(CHEMBL3769639)
Show SMILES FC(F)(F)c1ccc(CCCCOC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C15H17F3N2O3/c16-15(17,18)11-6-4-10(5-7-11)3-1-2-8-23-14(22)20-12-9-19-13(12)21/h4-7,12H,1-3,8-9H2,(H,19,21)(H,20,22)/t12-/m0/s1
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n/an/a 73n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151220
PNG
(CHEMBL3769678)
Show SMILES FC1(F)CCC(CCCCOC(=O)N[C@H]2CNC2=O)CC1 |r|
Show InChI InChI=1S/C14H22F2N2O3/c15-14(16)6-4-10(5-7-14)3-1-2-8-21-13(20)18-11-9-17-12(11)19/h10-11H,1-9H2,(H,17,19)(H,18,20)/t11-/m0/s1
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n/an/a 76n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human NAAA expressed in HEK293 cells after 30 mins by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151055
PNG
(CHEMBL3771111)
Show SMILES CCc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C13H16N2O3/c1-2-9-3-5-10(6-4-9)8-18-13(17)15-11-7-14-12(11)16/h3-6,11H,2,7-8H2,1H3,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 85n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Binding affinity to his-tagged human BRD4 bromodomain1 by isothermal titration calorimetric analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151127
PNG
(CHEMBL3770640)
Show SMILES CCCCCCCOC(=O)N[C@H]1CNC1=O |r|
Show InChI InChI=1S/C11H20N2O3/c1-2-3-4-5-6-7-16-11(15)13-9-8-12-10(9)14/h9H,2-8H2,1H3,(H,12,14)(H,13,15)/t9-/m0/s1
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n/an/a 122n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151148
PNG
(CHEMBL3769700)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc2CCCc2c1 |r|
Show InChI InChI=1S/C14H16N2O3/c17-13-12(7-15-13)16-14(18)19-8-9-4-5-10-2-1-3-11(10)6-9/h4-6,12H,1-3,7-8H2,(H,15,17)(H,16,18)/t12-/m0/s1
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n/an/a 130n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151152
PNG
(CHEMBL3771196)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc2CCCCc2c1 |r|
Show InChI InChI=1S/C15H18N2O3/c18-14-13(8-16-14)17-15(19)20-9-10-5-6-11-3-1-2-4-12(11)7-10/h5-7,13H,1-4,8-9H2,(H,16,18)(H,17,19)/t13-/m0/s1
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n/an/a 140n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151055
PNG
(CHEMBL3771111)
Show SMILES CCc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C13H16N2O3/c1-2-9-3-5-10(6-4-9)8-18-13(17)15-11-7-14-12(11)16/h3-6,11H,2,7-8H2,1H3,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 160n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151151
PNG
(CHEMBL3770354)
Show SMILES CCc1ccc(CCCCOC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C16H22N2O3/c1-2-12-6-8-13(9-7-12)5-3-4-10-21-16(20)18-14-11-17-15(14)19/h6-9,14H,2-5,10-11H2,1H3,(H,17,19)(H,18,20)/t14-/m0/s1
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n/an/a 230n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151236
PNG
(CHEMBL3770695)
Show SMILES C[C@@H]1NC(=O)[C@H]1NC(=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C15H26N2O3/c1-11-13(14(18)16-11)17-15(19)20-10-6-5-9-12-7-3-2-4-8-12/h11-13H,2-10H2,1H3,(H,16,18)(H,17,19)/t11-,13-/m0/s1
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n/an/a 240n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151096
PNG
(CHEMBL3769689)
Show SMILES CCCOc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C14H18N2O4/c1-2-7-19-11-5-3-10(4-6-11)9-20-14(18)16-12-8-15-13(12)17/h3-6,12H,2,7-9H2,1H3,(H,15,17)(H,16,18)/t12-/m0/s1
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n/an/a 250n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human BRD4 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151241
PNG
(CHEMBL3770549)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCCc1ccccc1 |r|
Show InChI InChI=1S/C15H20N2O3/c18-14-13(11-16-14)17-15(19)20-10-6-2-5-9-12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,16,18)(H,17,19)/t13-/m0/s1
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n/an/a 298n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151153
PNG
(CHEMBL3769597)
Show SMILES CC(C)(C)c1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C15H20N2O3/c1-15(2,3)11-6-4-10(5-7-11)9-20-14(19)17-12-8-16-13(12)18/h4-7,12H,8-9H2,1-3H3,(H,16,18)(H,17,19)/t12-/m0/s1
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n/an/a 310n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151222
PNG
(CHEMBL3770519)
Show SMILES CCCCC1CCC(CC1)OC(=O)N[C@H]1CNC1=O |r,wU:14.14,(-6.41,.92,;-5.34,1.53,;-4,.77,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;2.66,-3.08,;1.6,-3.7,;4,-3.86,;4,-5.4,;5.08,-6.44,;3.99,-7.52,;2.9,-6.43,;1.67,-6.41,)|
Show InChI InChI=1S/C14H24N2O3/c1-2-3-4-10-5-7-11(8-6-10)19-14(18)16-12-9-15-13(12)17/h10-12H,2-9H2,1H3,(H,15,17)(H,16,18)/t10?,11?,12-/m0/s1
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n/an/a 323n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151220
PNG
(CHEMBL3769678)
Show SMILES FC1(F)CCC(CCCCOC(=O)N[C@H]2CNC2=O)CC1 |r|
Show InChI InChI=1S/C14H22F2N2O3/c15-14(16)6-4-10(5-7-14)3-1-2-8-21-13(20)18-11-9-17-12(11)19/h10-11H,1-9H2,(H,17,19)(H,18,20)/t11-/m0/s1
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n/an/a 330n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human BRD3 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151053
PNG
(CHEMBL3770509)
Show SMILES CCCCCCCCC(=O)N[C@H]1CNC1=O |r|
Show InChI InChI=1S/C12H22N2O2/c1-2-3-4-5-6-7-8-11(15)14-10-9-13-12(10)16/h10H,2-9H2,1H3,(H,13,16)(H,14,15)/t10-/m0/s1
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n/an/a 340n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
Acid ceramidase


(Homo sapiens (Human))		BDBM50151154
PNG
(CHEMBL3770896)
Show SMILES CCCCc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C15H20N2O3/c1-2-3-4-11-5-7-12(8-6-11)10-20-15(19)17-13-9-16-14(13)18/h5-8,13H,2-4,9-10H2,1H3,(H,16,18)(H,17,19)/t13-/m0/s1
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n/an/a 390n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human acid ceramidase by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151238
PNG
(CHEMBL3770031)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C17H16N2O3/c20-16-15(10-18-16)19-17(21)22-11-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15H,10-11H2,(H,18,20)(H,19,21)/t15-/m0/s1
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n/an/a 513n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151147
PNG
(CHEMBL3770722)
Show SMILES COc1ccc(CCCCOC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C12H14N2O3/c1-8-2-4-9(5-3-8)7-17-12(16)14-10-6-13-11(10)15/h2-5,10H,6-7H2,1H3,(H,13,15)(H,14,16)/t10-/m0/s1
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n/an/a 520n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151147
PNG
(CHEMBL3770722)
Show SMILES COc1ccc(CCCCOC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C12H14N2O3/c1-8-2-4-9(5-3-8)7-17-12(16)14-10-6-13-11(10)15/h2-5,10H,6-7H2,1H3,(H,13,15)(H,14,16)/t10-/m0/s1
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n/an/a 1.04E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151150
PNG
(CHEMBL3769700)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCc1ccccc1 |r|
Show InChI InChI=1S/C14H18N2O3/c17-13-12(10-15-13)16-14(18)19-9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,15,17)(H,16,18)/t12-/m0/s1
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n/an/a 1.11E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151235
PNG
(CHEMBL3770450)
Show SMILES O=C(N[C@H]1CNC1=O)OCCOCC1CCCCC1 |r|
Show InChI InChI=1S/C13H22N2O4/c16-12-11(8-14-12)15-13(17)19-7-6-18-9-10-4-2-1-3-5-10/h10-11H,1-9H2,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 1.28E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human BRD2 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151039
PNG
(CHEMBL3770901)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc(cc1)-c1cocn1 |r|
Show InChI InChI=1S/C14H13N3O4/c18-13-11(5-15-13)17-14(19)21-6-9-1-3-10(4-2-9)12-7-20-8-16-12/h1-4,7-8,11H,5-6H2,(H,15,18)(H,17,19)/t11-/m0/s1
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n/an/a 1.37E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151039
PNG
(CHEMBL3770901)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc(cc1)-c1cocn1 |r|
Show InChI InChI=1S/C14H13N3O4/c18-13-11(5-15-13)17-14(19)21-6-9-1-3-10(4-2-9)12-7-20-8-16-12/h1-4,7-8,11H,5-6H2,(H,15,18)(H,17,19)/t11-/m0/s1
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n/an/a 1.37E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human BRD2 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
Acid ceramidase


(Homo sapiens (Human))		BDBM50151242
PNG
(CHEMBL3770525)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc(cc1)C1CCCCC1 |r|
Show InChI InChI=1S/C17H22N2O3/c20-16-15(10-18-16)19-17(21)22-11-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h6-9,13,15H,1-5,10-11H2,(H,18,20)(H,19,21)/t15-/m0/s1
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n/an/a 1.51E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human acid ceramidase by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151130
PNG
(CHEMBL3771259)
Show SMILES O=C(N[C@H]1CNC1=O)OCC\C=C/c1ccccc1 |r|
Show InChI InChI=1S/C14H16N2O3/c17-13-12(10-15-13)16-14(18)19-9-5-4-8-11-6-2-1-3-7-11/h1-4,6-8,12H,5,9-10H2,(H,15,17)(H,16,18)/b8-4-/t12-/m0/s1
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n/an/a 1.51E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151144
PNG
(CHEMBL3771368)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1cccc(c1)C1CCCCC1 |r|
Show InChI InChI=1S/C17H22N2O3/c20-16-15(10-18-16)19-17(21)22-11-12-5-4-8-14(9-12)13-6-2-1-3-7-13/h4-5,8-9,13,15H,1-3,6-7,10-11H2,(H,18,20)(H,19,21)/t15-/m0/s1
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n/an/a 1.72E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151129
PNG
(CHEMBL3769503)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc(OC2CCCCC2)cc1 |r|
Show InChI InChI=1S/C17H22N2O4/c20-16-15(10-18-16)19-17(21)22-11-12-6-8-14(9-7-12)23-13-4-2-1-3-5-13/h6-9,13,15H,1-5,10-11H2,(H,18,20)(H,19,21)/t15-/m0/s1
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n/an/a 2.07E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151099
PNG
(CHEMBL3770849)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc2OCOc2c1 |r|
Show InChI InChI=1S/C12H12N2O5/c15-11-8(4-13-11)14-12(16)17-5-7-1-2-9-10(3-7)19-6-18-9/h1-3,8H,4-6H2,(H,13,15)(H,14,16)/t8-/m0/s1
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n/an/a 2.19E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
Acid ceramidase


(Homo sapiens (Human))		BDBM50151096
PNG
(CHEMBL3769689)
Show SMILES CCCOc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C14H18N2O4/c1-2-7-19-11-5-3-10(4-6-11)9-20-14(18)16-12-8-15-13(12)17/h3-6,12H,2,7-9H2,1H3,(H,15,17)(H,16,18)/t12-/m0/s1
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n/an/a 2.41E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human acid ceramidase by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151224
PNG
(CHEMBL3770547)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCOC1CCCCC1 |r|
Show InChI InChI=1S/C13H22N2O4/c16-12-11(9-14-12)15-13(17)19-8-4-7-18-10-5-2-1-3-6-10/h10-11H,1-9H2,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 2.67E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151146
PNG
(CHEMBL3770146)
Show SMILES O=C(N[C@H]1CNC1=O)OCC\C=C\c1ccccc1 |r|
Show InChI InChI=1S/C14H16N2O3/c17-13-12(10-15-13)16-14(18)19-9-5-4-8-11-6-2-1-3-7-11/h1-4,6-8,12H,5,9-10H2,(H,15,17)(H,16,18)/b8-4+/t12-/m0/s1
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n/an/a 2.89E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151054
PNG
(CHEMBL3770250)
Show SMILES O=C(N[C@@H]1CNC1=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C14H24N2O3/c17-13-12(10-15-13)16-14(18)19-9-5-4-8-11-6-2-1-3-7-11/h11-12H,1-10H2,(H,15,17)(H,16,18)/t12-/m1/s1
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n/an/a 3.11E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151126
PNG
(CHEMBL3770640)
Show SMILES CC(OC(=O)N[C@H]1CNC1=O)c1ccc(cc1)C1CCCCC1 |r|
Show InChI InChI=1S/C18H24N2O3/c1-12(23-18(22)20-16-11-19-17(16)21)13-7-9-15(10-8-13)14-5-3-2-4-6-14/h7-10,12,14,16H,2-6,11H2,1H3,(H,19,21)(H,20,22)/t12?,16-/m0/s1
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n/an/a 4.47E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
Acid ceramidase


(Homo sapiens (Human))		BDBM50151057
PNG
(CHEMBL3770726)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C14H24N2O3/c17-13-12(10-15-13)16-14(18)19-9-5-4-8-11-6-2-1-3-7-11/h11-12H,1-10H2,(H,15,17)(H,16,18)/t12-/m0/s1
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n/an/a 6.27E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human acid ceramidase by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
Acid ceramidase


(Homo sapiens (Human))		BDBM50151055
PNG
(CHEMBL3771111)
Show SMILES CCc1ccc(COC(=O)N[C@H]2CNC2=O)cc1 |r|
Show InChI InChI=1S/C13H16N2O3/c1-2-9-3-5-10(6-4-9)8-18-13(17)15-11-7-14-12(11)16/h3-6,11H,2,7-8H2,1H3,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 8.09E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human acid ceramidase by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151056
PNG
(CHEMBL3769770)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccc(cc1)-c1cccnc1 |r|
Show InChI InChI=1S/C16H15N3O3/c20-15-14(9-18-15)19-16(21)22-10-11-3-5-12(6-4-11)13-2-1-7-17-8-13/h1-8,14H,9-10H2,(H,18,20)(H,19,21)/t14-/m0/s1
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n/an/a 8.11E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151232
PNG
(CHEMBL3769763)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCC1CCOCC1 |r|
Show InChI InChI=1S/C13H22N2O4/c16-12-11(9-14-12)15-13(17)19-6-2-1-3-10-4-7-18-8-5-10/h10-11H,1-9H2,(H,14,16)(H,15,17)/t11-/m0/s1
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n/an/a 9.51E+3n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
Acid ceramidase


(Homo sapiens (Human))		BDBM50151220
PNG
(CHEMBL3769678)
Show SMILES FC1(F)CCC(CCCCOC(=O)N[C@H]2CNC2=O)CC1 |r|
Show InChI InChI=1S/C14H22F2N2O3/c15-14(16)6-4-10(5-7-14)3-1-2-8-21-13(20)18-11-9-17-12(11)19/h10-11H,1-9H2,(H,17,19)(H,18,20)/t11-/m0/s1
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n/an/a 1.05E+4n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human acid ceramidase by UPLC/MS analysis

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151103
PNG
(CHEMBL3769976)
Show SMILES O=C(N[C@H]1CNC1=O)OCc1ccccc1C1CCCCC1 |r|
Show InChI InChI=1S/C17H22N2O3/c20-16-15(10-18-16)19-17(21)22-11-13-8-4-5-9-14(13)12-6-2-1-3-7-12/h4-5,8-9,12,15H,1-3,6-7,10-11H2,(H,18,20)(H,19,21)/t15-/m0/s1
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n/an/a 1.28E+4n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151221
PNG
(CHEMBL3771160)
Show SMILES C[C@@H]1NC(=O)[C@@H]1NC(=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C15H26N2O3/c1-11-13(14(18)16-11)17-15(19)20-10-6-5-9-12-7-3-2-4-8-12/h11-13H,2-10H2,1H3,(H,16,18)(H,17,19)/t11-,13+/m0/s1
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n/an/a 1.29E+4n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human BRD3 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151156
PNG
(CHEMBL3769863)
Show SMILES CC1(C)NC(=O)[C@@H]1NC(=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C16H28N2O3/c1-16(2)13(14(19)18-16)17-15(20)21-11-7-6-10-12-8-4-3-5-9-12/h12-13H,3-11H2,1-2H3,(H,17,20)(H,18,19)/t13-/m0/s1
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n/an/a 1.73E+4n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human BRD4 bromodomain2 using H4KAc 5/8/12/16 peptide as substrate incubated overnight by HTRF assay

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151223
PNG
(CHEMBL3771292)
Show SMILES CC1(C)NC(=O)[C@H]1NC(=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C16H28N2O3/c1-16(2)13(14(19)18-16)17-15(20)21-11-7-6-10-12-8-4-3-5-9-12/h12-13H,3-11H2,1-2H3,(H,17,20)(H,18,19)/t13-/m1/s1
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n/an/a 2.54E+4n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151225
PNG
(CHEMBL3771358)
Show SMILES C[C@H]1NC(=O)[C@@H]1NC(=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C15H26N2O3/c1-11-13(14(18)16-11)17-15(19)20-10-6-5-9-12-7-3-2-4-8-12/h11-13H,2-10H2,1H3,(H,16,18)(H,17,19)/t11-,13-/m1/s1
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n/an/a 2.94E+4n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151145
PNG
(CHEMBL3771150)
Show SMILES O=C(N[C@H]1CNC1=O)OCCCCc1ccccn1 |r|
Show InChI InChI=1S/C13H17N3O3/c17-12-11(9-15-12)16-13(18)19-8-4-2-6-10-5-1-3-7-14-10/h1,3,5,7,11H,2,4,6,8-9H2,(H,15,17)(H,16,18)/t11-/m0/s1
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n/an/a 3.07E+4n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))		BDBM50151233
PNG
(CHEMBL3770388)
Show SMILES C[C@H]1NC(=O)[C@H]1NC(=O)OCCCCC1CCCCC1 |r|
Show InChI InChI=1S/C15H26N2O3/c1-11-13(14(18)16-11)17-15(19)20-10-6-5-9-12-7-3-2-4-8-12/h11-13H,2-10H2,1H3,(H,16,18)(H,17,19)/t11-,13+/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



Italian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human NAAA expressed in HEK293 cells preincubated for 10 mins followed by N-(4-methyl-2-oxo-chromen-7-yl)-hexadecanamide substrate addi...

Eur J Med Chem 111: 138-59 (2016)


Article DOI: 10.1016/j.ejmech.2016.01.046
BindingDB Entry DOI: 10.7270/Q2GQ70MX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%