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10 similar compounds to monomer 50118169

Wt: 210.6
BDBM50319927
Wt: 210.6
BDBM50319928
Wt: 224.6
BDBM50319929
Wt: 224.6
BDBM50319930
Wt: 239.7
BDBM50319931
Wt: 499.6
BDBM50118163
Purchase
Wt: 312.3
BDBM50118166
Wt: 325.3
BDBM50118170
Wt: 312.3
BDBM50118165
Wt: 283.2
BDBM50118168

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 27 hits for monomerid = 50319927,50319928,50319929,50319930,50319931,50118163,50118166,50118170,50118165,50118168   
Target
(Institution)
LigandTarget
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
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit


(Rattus norvegicus (Rat))
BDBM50319928
PNG
((1R,4R)-2-(6-chloropyridazin-3-yl)-2,5-diazabicycl...)
Show SMILES Clc1ccc(nn1)N1C[C@H]2C[C@@H]1CN2
Show InChI InChI=1S/C9H11ClN4/c10-8-1-2-9(13-12-8)14-5-6-3-7(14)4-11-6/h1-2,6-7,11H,3-5H2/t6-,7-/m1/s1
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0.200n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]cytisine from alpha4beta2 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit


(Rattus norvegicus (Rat))
BDBM50319931
PNG
((1S,4S)-5-(6-chloropyridazin-3-yl)-2,2-dimethyl-5-...)
Show SMILES C[N+]1(C)C[C@@H]2C[C@H]1CN2c1ccc(Cl)nn1
Show InChI InChI=1S/C11H16ClN4/c1-16(2)7-8-5-9(16)6-15(8)11-4-3-10(12)13-14-11/h3-4,8-9H,5-7H2,1-2H3/q+1/t8-,9-/m0/s1
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4.30n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]cytisine from alpha4beta2 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit


(Rattus norvegicus (Rat))
BDBM50319927
PNG
((1S,4S)-2-(6-chloropyridazin-3-yl)-2,5-diazabicycl...)
Show SMILES Clc1ccc(nn1)N1C[C@@H]2C[C@H]1CN2
Show InChI InChI=1S/C9H11ClN4/c10-8-1-2-9(13-12-8)14-5-6-3-7(14)4-11-6/h1-2,6-7,11H,3-5H2/t6-,7-/m0/s1
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6n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]cytisine from alpha4beta2 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50319931
PNG
((1S,4S)-5-(6-chloropyridazin-3-yl)-2,2-dimethyl-5-...)
Show SMILES C[N+]1(C)C[C@@H]2C[C@H]1CN2c1ccc(Cl)nn1
Show InChI InChI=1S/C11H16ClN4/c1-16(2)7-8-5-9(16)6-15(8)11-4-3-10(12)13-14-11/h3-4,8-9H,5-7H2,1-2H3/q+1/t8-,9-/m0/s1
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21.5n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]A585539 from alpha7 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit


(Rattus norvegicus (Rat))
BDBM50319930
PNG
((1R,4R)-2-(6-chloropyridazin-3-yl)-5-methyl-2,5-di...)
Show SMILES CN1C[C@H]2C[C@@H]1CN2c1ccc(Cl)nn1
Show InChI InChI=1S/C10H13ClN4/c1-14-5-8-4-7(14)6-15(8)10-3-2-9(11)12-13-10/h2-3,7-8H,4-6H2,1H3/t7-,8-/m1/s1
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26n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]cytisine from alpha4beta2 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit


(Rattus norvegicus (Rat))
BDBM50319929
PNG
((1S,4S)-2-(6-chloropyridazin-3-yl)-5-methyl-2,5-di...)
Show SMILES CN1C[C@@H]2C[C@H]1CN2c1ccc(Cl)nn1
Show InChI InChI=1S/C10H13ClN4/c1-14-5-8-4-7(14)6-15(8)10-3-2-9(11)12-13-10/h2-3,7-8H,4-6H2,1H3/t7-,8-/m0/s1
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139n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]cytisine from alpha4beta2 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50319927
PNG
((1S,4S)-2-(6-chloropyridazin-3-yl)-2,5-diazabicycl...)
Show SMILES Clc1ccc(nn1)N1C[C@@H]2C[C@H]1CN2
Show InChI InChI=1S/C9H11ClN4/c10-8-1-2-9(13-12-8)14-5-6-3-7(14)4-11-6/h1-2,6-7,11H,3-5H2/t6-,7-/m0/s1
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303n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]A585539 from alpha7 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50319928
PNG
((1R,4R)-2-(6-chloropyridazin-3-yl)-2,5-diazabicycl...)
Show SMILES Clc1ccc(nn1)N1C[C@H]2C[C@@H]1CN2
Show InChI InChI=1S/C9H11ClN4/c10-8-1-2-9(13-12-8)14-5-6-3-7(14)4-11-6/h1-2,6-7,11H,3-5H2/t6-,7-/m1/s1
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486n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]A585539 from alpha7 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50319930
PNG
((1R,4R)-2-(6-chloropyridazin-3-yl)-5-methyl-2,5-di...)
Show SMILES CN1C[C@H]2C[C@@H]1CN2c1ccc(Cl)nn1
Show InChI InChI=1S/C10H13ClN4/c1-14-5-8-4-7(14)6-15(8)10-3-2-9(11)12-13-10/h2-3,7-8H,4-6H2,1H3/t7-,8-/m1/s1
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748n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]A585539 from alpha7 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50319929
PNG
((1S,4S)-2-(6-chloropyridazin-3-yl)-5-methyl-2,5-di...)
Show SMILES CN1C[C@@H]2C[C@H]1CN2c1ccc(Cl)nn1
Show InChI InChI=1S/C10H13ClN4/c1-14-5-8-4-7(14)6-15(8)10-3-2-9(11)12-13-10/h2-3,7-8H,4-6H2,1H3/t7-,8-/m0/s1
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1.48E+3n/an/an/an/an/an/an/an/a



Abbott Park

Curated by ChEMBL


Assay Description
Displacement of [3H]A585539 from alpha7 nACHR in rat brain homogenate


Bioorg Med Chem Lett 20: 3636-9 (2010)

More data for this
Ligand-Target Pair
Monoglyceride lipase


(Homo sapiens (human))
BDBM50118166
PNG
(CHEMBL3613663)
Show SMILES COc1nn(Cc2ccc(OCc3ccccc3)cc2)c(=O)o1
Show InChI InChI=1S/C17H16N2O4/c1-21-16-18-19(17(20)23-16)11-13-7-9-15(10-8-13)22-12-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
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n/an/a 520n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human MAGL expressed in HEK293 cells pre-incubated for 10 mins before 2-AG substrate addition by HPLC method


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Monoglyceride lipase


(Homo sapiens (human))
BDBM50118170
PNG
(CHEMBL3613661)
Show SMILES COc1nn(Cc2ccc(NC(=O)c3ccccc3)cc2)c(=O)o1
Show InChI InChI=1S/C17H15N3O4/c1-23-16-19-20(17(22)24-16)11-12-7-9-14(10-8-12)18-15(21)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,21)
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n/an/a 560n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human MAGL expressed in HEK293 cells pre-incubated for 10 mins before 2-AG substrate addition by HPLC method


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Monoglyceride lipase


(Homo sapiens (human))
BDBM50118170
PNG
(CHEMBL3613661)
Show SMILES COc1nn(Cc2ccc(NC(=O)c3ccccc3)cc2)c(=O)o1
Show InChI InChI=1S/C17H15N3O4/c1-23-16-19-20(17(22)24-16)11-12-7-9-14(10-8-12)18-15(21)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,21)
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n/an/a 562n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human MAGL expressed in HEK293 cells pre-incubated for 10 mins before 2-AG substrate addition by HPLC method


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Monoglyceride lipase


(Homo sapiens (human))
BDBM50118165
PNG
(CHEMBL3613662)
Show SMILES COc1nn(Cc2cccc(OCc3ccccc3)c2)c(=O)o1
Show InChI InChI=1S/C17H16N2O4/c1-21-16-18-19(17(20)23-16)11-14-8-5-9-15(10-14)22-12-13-6-3-2-4-7-13/h2-10H,11-12H2,1H3
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n/an/a 3.24E+3n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human MAGL expressed in HEK293 cells pre-incubated for 10 mins before 2-AG substrate addition by HPLC method


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Monoglyceride lipase


(Homo sapiens (human))
BDBM50118165
PNG
(CHEMBL3613662)
Show SMILES COc1nn(Cc2cccc(OCc3ccccc3)c2)c(=O)o1
Show InChI InChI=1S/C17H16N2O4/c1-21-16-18-19(17(20)23-16)11-14-8-5-9-15(10-14)22-12-13-6-3-2-4-7-13/h2-10H,11-12H2,1H3
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n/an/a 3.23E+3n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human MAGL expressed in HEK293 cells pre-incubated for 10 mins before 2-AG substrate addition by HPLC method


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Monoglyceride lipase


(Homo sapiens (human))
BDBM50118168
PNG
(CHEMBL3613162)
Show SMILES Nc1cccc(Cn2nc(Oc3ccccc3)oc2=O)c1
Show InChI InChI=1S/C15H13N3O3/c16-12-6-4-5-11(9-12)10-18-15(19)21-14(17-18)20-13-7-2-1-3-8-13/h1-9H,10,16H2
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n/an/a 7.94E+3n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human MAGL expressed in HEK293 cells pre-incubated for 10 mins before 2-AG substrate addition by HPLC method


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Monoglyceride lipase


(Homo sapiens (human))
BDBM50118166
PNG
(CHEMBL3613663)
Show SMILES COc1nn(Cc2ccc(OCc3ccccc3)cc2)c(=O)o1
Show InChI InChI=1S/C17H16N2O4/c1-21-16-18-19(17(20)23-16)11-13-7-9-15(10-8-13)22-12-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
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n/an/a 525n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human MAGL expressed in HEK293 cells pre-incubated for 10 mins before 2-AG substrate addition by HPLC method


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Monoacylglycerol lipase ABHD6


(Homo sapiens)
BDBM50118168
PNG
(CHEMBL3613162)
Show SMILES Nc1cccc(Cn2nc(Oc3ccccc3)oc2=O)c1
Show InChI InChI=1S/C15H13N3O3/c16-12-6-4-5-11(9-12)10-18-15(19)21-14(17-18)20-13-7-2-1-3-8-13/h1-9H,10,16H2
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n/an/a 73n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human ABHD6 expressed in HEK293 cells assessed as reduction in glycerol production from 1-AG hydrolysis pre-incubated for 30 mins befor...


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Monoacylglycerol lipase ABHD6


(Homo sapiens)
BDBM50118168
PNG
(CHEMBL3613162)
Show SMILES Nc1cccc(Cn2nc(Oc3ccccc3)oc2=O)c1
Show InChI InChI=1S/C15H13N3O3/c16-12-6-4-5-11(9-12)10-18-15(19)21-14(17-18)20-13-7-2-1-3-8-13/h1-9H,10,16H2
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n/an/a 74n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human ABHD6 expressed in HEK293 cells assessed as reduction in glycerol production from 1-AG hydrolysis pre-incubated for 30 mins befor...


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (human))
BDBM50118163
PNG
(CHEMBL3612849)
Show SMILES CC(C)(C)OC(=O)N1CCCC(=C1)c1cnc(N)c2c(csc12)-c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C29H29N3O3S/c1-29(2,3)35-28(33)32-15-7-8-20(17-32)23-16-31-27(30)25-24(18-36-26(23)25)19-11-13-22(14-12-19)34-21-9-5-4-6-10-21/h4-6,9-14,16-18H,7-8,15H2,1-3H3,(H2,30,31)
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n/an/a 2.87E+3n/an/an/an/an/an/a



Xi'an Jiaotong University

Curated by ChEMBL


Assay Description
Inhibition of BTK (unknown origin) after 1 hr by TR-FRET assay


Bioorg Med Chem 23: 6250-7 (2015)

More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Homo sapiens (human))
BDBM50118165
PNG
(CHEMBL3613662)
Show SMILES COc1nn(Cc2cccc(OCc3ccccc3)c2)c(=O)o1
Show InChI InChI=1S/C17H16N2O4/c1-21-16-18-19(17(20)23-16)11-14-8-5-9-15(10-14)22-12-13-6-3-2-4-7-13/h2-10H,11-12H2,1H3
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n/an/a 1.51E+3n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human FAAH expressed in COS7 cell membranes pre-incubated for 10 mins before [3H]-AEA substrate addition by liquid scintillation counti...


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Homo sapiens (human))
BDBM50118165
PNG
(CHEMBL3613662)
Show SMILES COc1nn(Cc2cccc(OCc3ccccc3)c2)c(=O)o1
Show InChI InChI=1S/C17H16N2O4/c1-21-16-18-19(17(20)23-16)11-14-8-5-9-15(10-14)22-12-13-6-3-2-4-7-13/h2-10H,11-12H2,1H3
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n/an/a 1.51E+3n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human FAAH expressed in COS7 cell membranes pre-incubated for 10 mins before [3H]-AEA substrate addition by liquid scintillation counti...


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Monoglyceride lipase


(Homo sapiens (human))
BDBM50118168
PNG
(CHEMBL3613162)
Show SMILES Nc1cccc(Cn2nc(Oc3ccccc3)oc2=O)c1
Show InChI InChI=1S/C15H13N3O3/c16-12-6-4-5-11(9-12)10-18-15(19)21-14(17-18)20-13-7-2-1-3-8-13/h1-9H,10,16H2
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n/an/a 7.94E+3n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human MAGL expressed in HEK293 cells pre-incubated for 10 mins before 2-AG substrate addition by HPLC method


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Homo sapiens (human))
BDBM50118166
PNG
(CHEMBL3613663)
Show SMILES COc1nn(Cc2ccc(OCc3ccccc3)cc2)c(=O)o1
Show InChI InChI=1S/C17H16N2O4/c1-21-16-18-19(17(20)23-16)11-13-7-9-15(10-8-13)22-12-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
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n/an/a 410n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human FAAH expressed in COS7 cell membranes pre-incubated for 10 mins before [3H]-AEA substrate addition by liquid scintillation counti...


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Homo sapiens (human))
BDBM50118170
PNG
(CHEMBL3613661)
Show SMILES COc1nn(Cc2ccc(NC(=O)c3ccccc3)cc2)c(=O)o1
Show InChI InChI=1S/C17H15N3O4/c1-23-16-19-20(17(22)24-16)11-12-7-9-14(10-8-12)18-15(21)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,21)
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n/an/a 617n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human FAAH expressed in COS7 cell membranes pre-incubated for 10 mins before [3H]-AEA substrate addition by liquid scintillation counti...


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Homo sapiens (human))
BDBM50118170
PNG
(CHEMBL3613661)
Show SMILES COc1nn(Cc2ccc(NC(=O)c3ccccc3)cc2)c(=O)o1
Show InChI InChI=1S/C17H15N3O4/c1-23-16-19-20(17(22)24-16)11-12-7-9-14(10-8-12)18-15(21)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,21)
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n/an/a 620n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human FAAH expressed in COS7 cell membranes pre-incubated for 10 mins before [3H]-AEA substrate addition by liquid scintillation counti...


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Homo sapiens (human))
BDBM50118166
PNG
(CHEMBL3613663)
Show SMILES COc1nn(Cc2ccc(OCc3ccccc3)cc2)c(=O)o1
Show InChI InChI=1S/C17H16N2O4/c1-21-16-18-19(17(20)23-16)11-13-7-9-15(10-8-13)22-12-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
PDB
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n/an/a 407n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Inhibition of human FAAH expressed in COS7 cell membranes pre-incubated for 10 mins before [3H]-AEA substrate addition by liquid scintillation counti...


Bioorg Med Chem 23: 6335-45 (2015)

More data for this
Ligand-Target Pair