Found 524 hits Enz. Inhib. hit(s) with Target = 'Monoacylglycerol lipase ABHD6' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM50048620
(CHEMBL3319620)Show SMILES CC1(C)CCc2cc(ccc2O1)S(=O)(=O)N(CC(O)=O)Cc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C26H27NO6S/c1-26(2)15-14-20-16-23(12-13-24(20)33-26)34(30,31)27(18-25(28)29)17-19-8-10-22(11-9-19)32-21-6-4-3-5-7-21/h3-13,16H,14-15,17-18H2,1-2H3,(H,28,29) | PDB
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| 800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Co.
Curated by ChEMBL
| Assay Description
Inhibition of ABHD6 (unknown origin) |
Bioorg Med Chem 24: 1455-68 (2016)
Article DOI: 10.1016/j.bmc.2016.02.006
BindingDB Entry DOI: 10.7270/Q2RJ4MBD |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM50048620
(CHEMBL3319620)Show SMILES CC1(C)CCc2cc(ccc2O1)S(=O)(=O)N(CC(O)=O)Cc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C26H27NO6S/c1-26(2)15-14-20-16-23(12-13-24(20)33-26)34(30,31)27(18-25(28)29)17-19-8-10-22(11-9-19)32-21-6-4-3-5-7-21/h3-13,16H,14-15,17-18H2,1-2H3,(H,28,29) | PDB
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| 800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Leiden University
Curated by ChEMBL
| Assay Description
Inhibition of human ABHD6 expressed in HEK293T cell membranes assessed as reduction in glycerol production using 2-arachidonoyl glycerol substrate |
J Med Chem 57: 6610-22 (2014)
Article DOI: 10.1021/jm500681z
BindingDB Entry DOI: 10.7270/Q2R49SD4 |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM50048620
(CHEMBL3319620)Show SMILES CC1(C)CCc2cc(ccc2O1)S(=O)(=O)N(CC(O)=O)Cc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C26H27NO6S/c1-26(2)15-14-20-16-23(12-13-24(20)33-26)34(30,31)27(18-25(28)29)17-19-8-10-22(11-9-19)32-21-6-4-3-5-7-21/h3-13,16H,14-15,17-18H2,1-2H3,(H,28,29) | PDB
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TBA
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More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM50048618
(CHEMBL3319622)Show SMILES CC1(C)CCc2cc(ccc2O1)S(=O)(=O)N(CC(O)=O)Cc1ccc(Oc2ccc(cn2)C(F)(F)F)cc1 Show InChI InChI=1S/C26H25F3N2O6S/c1-25(2)12-11-18-13-21(8-9-22(18)37-25)38(34,35)31(16-24(32)33)15-17-3-6-20(7-4-17)36-23-10-5-19(14-30-23)26(27,28)29/h3-10,13-14H,11-12,15-16H2,1-2H3,(H,32,33) | PDB
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| 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Leiden University
Curated by ChEMBL
| Assay Description
Inhibition of human ABHD6 expressed in HEK293T cell membranes assessed as reduction in glycerol production using 2-arachidonoyl glycerol substrate |
J Med Chem 57: 6610-22 (2014)
Article DOI: 10.1021/jm500681z
BindingDB Entry DOI: 10.7270/Q2R49SD4 |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM50048621
(CHEMBL3319619)Show SMILES CC1(C)CCc2cc(ccc2O1)S(=O)(=O)N(CC(O)=O)Cc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C26H27NO6S/c1-26(2)14-13-20-16-23(11-12-24(20)33-26)34(30,31)27(18-25(28)29)17-19-7-6-10-22(15-19)32-21-8-4-3-5-9-21/h3-12,15-16H,13-14,17-18H2,1-2H3,(H,28,29) | PDB
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| 1.83E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Leiden University
Curated by ChEMBL
| Assay Description
Inhibition of human ABHD6 expressed in HEK293T cell membranes assessed as reduction in glycerol production using 2-arachidonoyl glycerol substrate |
J Med Chem 57: 6610-22 (2014)
Article DOI: 10.1021/jm500681z
BindingDB Entry DOI: 10.7270/Q2R49SD4 |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM26736
(CHEMBL509860 | LY2183240 | N,N-dimethyl-5-[(4-phen...)Show InChI InChI=1S/C17H17N5O/c1-21(2)17(23)22-16(18-19-20-22)12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3 | PDB
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| n/a | n/a | 0.0900 | n/a | n/a | n/a | n/a | 7.4 | 22 |
The Scripps Research Institute
| Assay Description
Serine hydrolase targets were recombinantly expressed in COS-7 cells by transient transfection. IC50 values were obtained by competitive ABPP with F... |
J Am Chem Soc 128: 9699-704 (2006)
Article DOI: 10.1021/ja062999h
BindingDB Entry DOI: 10.7270/Q20K26VX |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010336
(CHEMBL3263579)Show SMILES O=C(N1CCCCC1)c1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1c1ccccc1 Show InChI InChI=1S/C32H33N5O2/c38-31(35-19-6-2-7-20-35)28-13-9-12-27(22-28)24-15-17-25(18-16-24)29-23-37(34-33-29)32(39)36-21-8-5-14-30(36)26-10-3-1-4-11-26/h1,3-4,9-13,15-18,22-23,30H,2,5-8,14,19-21H2 | PDB
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| n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
In situ inhibition of ABHD6 in mouse Neuro2a cells after 4 hrs by ABPP-SILAC-based LC-MS/MS analysis |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010335
(CHEMBL3263577)Show SMILES OCc1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1c1ccccc1 Show InChI InChI=1S/C27H26N4O2/c32-19-20-7-6-10-24(17-20)21-12-14-22(15-13-21)25-18-31(29-28-25)27(33)30-16-5-4-11-26(30)23-8-2-1-3-9-23/h1-3,6-10,12-15,17-18,26,32H,4-5,11,16,19H2 | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
In situ inhibition of ABHD6 in mouse Neuro2a cells after 4 hrs by ABPP-SILAC-based LC-MS/MS analysis |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010337
(CHEMBL3263582)Show SMILES OC(=O)c1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1Cc1ccccc1 Show InChI InChI=1S/C28H26N4O3/c33-27(34)24-10-6-9-23(18-24)21-12-14-22(15-13-21)26-19-32(30-29-26)28(35)31-16-5-4-11-25(31)17-20-7-2-1-3-8-20/h1-3,6-10,12-15,18-19,25H,4-5,11,16-17H2,(H,33,34) | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
In situ inhibition of ABHD6 in mouse Neuro2a cells after 4 hrs by ABPP-SILAC-based LC-MS/MS analysis |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010336
(CHEMBL3263579)Show SMILES O=C(N1CCCCC1)c1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1c1ccccc1 Show InChI InChI=1S/C32H33N5O2/c38-31(35-19-6-2-7-20-35)28-13-9-12-27(22-28)24-15-17-25(18-16-24)29-23-37(34-33-29)32(39)36-21-8-5-14-30(36)26-10-3-1-4-11-26/h1,3-4,9-13,15-18,22-23,30H,2,5-8,14,19-21H2 | PDB
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| n/a | n/a | 0.210 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
In situ inhibition of ABHD6 in mouse Neuro2a cells after 4 hrs by gel-based competitive ABPP assay |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010335
(CHEMBL3263577)Show SMILES OCc1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1c1ccccc1 Show InChI InChI=1S/C27H26N4O2/c32-19-20-7-6-10-24(17-20)21-12-14-22(15-13-21)25-18-31(29-28-25)27(33)30-16-5-4-11-26(30)23-8-2-1-3-9-23/h1-3,6-10,12-15,17-18,26,32H,4-5,11,16,19H2 | PDB
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| n/a | n/a | 0.240 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description
In situ inhibition of ABHD6 in mouse Neuro2a cells after 4 hrs by gel-based competitive ABPP assay |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010337
(CHEMBL3263582)Show SMILES OC(=O)c1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1Cc1ccccc1 Show InChI InChI=1S/C28H26N4O3/c33-27(34)24-10-6-9-23(18-24)21-12-14-22(15-13-21)26-19-32(30-29-26)28(35)31-16-5-4-11-25(31)17-20-7-2-1-3-8-20/h1-3,6-10,12-15,18-19,25H,4-5,11,16-17H2,(H,33,34) | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
In situ inhibition of ABHD6 in mouse Neuro2a cells after 4 hrs by gel-based competitive ABPP assay |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010337
(CHEMBL3263582)Show SMILES OC(=O)c1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1Cc1ccccc1 Show InChI InChI=1S/C28H26N4O3/c33-27(34)24-10-6-9-23(18-24)21-12-14-22(15-13-21)26-19-32(30-29-26)28(35)31-16-5-4-11-25(31)17-20-7-2-1-3-8-20/h1-3,6-10,12-15,18-19,25H,4-5,11,16-17H2,(H,33,34) | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of ABHD6 in FP-rhodamine-labelled mouse brain membrane preincubated for 30 mins followed by FP-rhodamine labelling measured after 30 mins ... |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645023
(US20240010658, Example 3-10)Show SMILES Brc1ccc(N[C@@H]2CC[C@H]3CN(C[C@@H]23)C(=O)c2cc3nn(cc3s2)C2CC2)nn1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645014
(US20240010658, Example 1-2)Show SMILES Cc1ccc(s1)C(=O)N1C[C@@H]2CC[C@@H](Nc3ccc(Cl)nn3)[C@@H]2C1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645015
(US20240010658, Example 1-4)Show SMILES Clc1ccc(N[C@@H]2CC[C@H]3CN(C[C@@H]23)C(=O)c2cc3COCCc3s2)nn1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645016
(US20240010658, Example 2)Show SMILES Cc1ccc(s1)C(=O)N1C[C@@H]2CC[C@@H](Nc3ccc(Br)nn3)[C@@H]2C1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645017
(US20240010658, Example 2-1)Show SMILES Brc1ccc(N[C@@H]2CC[C@H]3CN(C[C@@H]23)C(=O)c2cc3COCCc3s2)nn1 |r| | PDB
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Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645022
(US20240010658, Example 3-9)Show SMILES Cn1cc2sc(cc2n1)C(=O)N1C[C@@H]2CC[C@@H](Nc3ccc(Br)nn3)[C@@H]2C1 |r| | PDB
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Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645013
(US20240010658, Example 1)Show SMILES FC(F)c1ccc(s1)C(=O)N1C[C@@H]2CC[C@@H](Nc3ccc(Cl)nn3)[C@@H]2C1 |r| | PDB
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Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645024
(US20240010658, Example 5)Show SMILES Cc1ccc(s1)C(=O)N1C[C@@H]2CC[C@@H](Nc3ccc(I)nn3)[C@@H]2C1 |r| | PDB
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Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645026
(US20240010658, Example 6-2)Show SMILES Cc1ccc(s1)C(=O)N1C[C@@H]2CC[C@H]([C@@H]2C1)N(Cc1ccccc1)c1ccc(Br)nn1 |r| | PDB
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Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645027
(US20240010658, Example 8-1)Show SMILES Cc1ccc(s1)C(=O)N1C[C@@H]2CC[C@H]([C@@H]2C1)n1ccc2cc(Cl)nnc12 |r| | PDB
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Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645029
(US20240010658, Example 10)Show SMILES Cc1ccc(s1)C(=O)N1C[C@@H]2CC[C@@H](Nc3ccc(Br)nn3)[C@]2(F)C1 |r| | PDB
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Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645030
(US20240010658, Example 12)Show SMILES F[C@@]12CN(C[C@@H]1CC[C@H]2Nc1ccc(Cl)nn1)C(=O)c1cc2COCCc2s1 |r| | PDB
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Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645031
(US20240010658, Example 15)Show SMILES Brc1ccc(N[C@H]2[C@@H]3CN(C[C@@H]3CC22CC2)C(=O)c2cc3COCCc3s2)nn1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645032
(US20240010658, Example 16)Show SMILES FC1(F)C[C@@H](Nc2ccc(Br)nn2)[C@@H]2CN(C[C@H]12)C(=O)c1cc2COCCc2s1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010336
(CHEMBL3263579)Show SMILES O=C(N1CCCCC1)c1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1c1ccccc1 Show InChI InChI=1S/C32H33N5O2/c38-31(35-19-6-2-7-20-35)28-13-9-12-27(22-28)24-15-17-25(18-16-24)29-23-37(34-33-29)32(39)36-21-8-5-14-30(36)26-10-3-1-4-11-26/h1,3-4,9-13,15-18,22-23,30H,2,5-8,14,19-21H2 | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of ABHD6 in FP-rhodamine-labelled mouse brain membrane preincubated for 30 mins followed by FP-rhodamine labelling measured after 30 mins ... |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010335
(CHEMBL3263577)Show SMILES OCc1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1c1ccccc1 Show InChI InChI=1S/C27H26N4O2/c32-19-20-7-6-10-24(17-20)21-12-14-22(15-13-21)25-18-31(29-28-25)27(33)30-16-5-4-11-26(30)23-8-2-1-3-9-23/h1-3,6-10,12-15,17-18,26,32H,4-5,11,16,19H2 | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of ABHD6 in FP-rhodamine-labelled mouse brain membrane preincubated for 30 mins followed by FP-rhodamine labelling measured after 30 mins ... |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | CHEMBL5274434
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645021
(US20240010658, Example 3-6)Show SMILES Brc1ccc(N[C@@H]2CC[C@H]3CN(C[C@@H]23)C(=O)c2cc3nn4CCCc4c3s2)nn1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645019
(US20240010658, Example 2-14)Show SMILES Brc1ccc(N[C@@H]2CC[C@H]3CN(C[C@@H]23)C(=O)C2CC3CCC2CC3)nn1 |r,wU:9.9,13.12,wD:6.5,(8.14,-1.27,;6.68,-.8,;6.36,.71,;4.89,1.18,;3.75,.15,;2.28,.63,;1.14,-.4,;1.3,-1.93,;-.11,-2.56,;-1.14,-1.41,;-2.65,-1.09,;-2.81,.44,;-1.4,1.06,;-.37,-.08,;-4.14,1.21,;-4.14,2.75,;-5.47,.44,;-6.81,1.21,;-8.14,.44,;-8.14,-1.1,;-6.81,-1.87,;-5.47,-1.1,;-6.28,.19,;-7.37,-.9,;4.07,-1.35,;5.53,-1.83,)| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645018
(US20240010658, Example 2-6)Show SMILES CN(C)c1ncc(s1)C(=O)N1C[C@@H]2CC[C@@H](Nc3ccc(Br)nn3)[C@@H]2C1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645028
(US20240010658, Example 9)Show SMILES Cc1ccc(s1)C(=O)N1C[C@@H]2CC[C@@H](Nc3nnc(Cl)cc3C#N)[C@@H]2C1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645025
(US20240010658, Example 6)Show SMILES CN([C@@H]1CC[C@H]2CN(C[C@@H]12)C(=O)c1ccc(C)s1)c1ccc(Br)nn1 |r| | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM50211257
(CHEMBL3895863 | US10583137, Compound 14)Show SMILES OC(c1cnn(n1)C(=O)N1C[C@@H](CC[C@@H]1Cc1ccccc1)OCC#C)(c1ccc(F)cc1)c1ccc(F)cc1 |r| Show InChI InChI=1S/C31H28F2N4O3/c1-2-18-40-28-17-16-27(19-22-6-4-3-5-7-22)36(21-28)30(38)37-34-20-29(35-37)31(39,23-8-12-25(32)13-9-23)24-10-14-26(33)15-11-24/h1,3-15,20,27-28,39H,16-19,21H2/t27-,28-/m1/s1 | PDB
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Leiden University
Curated by ChEMBL
| Assay Description
Inhibition of human ABHD6 using 2-AG as natural substrate by fluorescence based assay |
J Med Chem 60: 428-440 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01482
BindingDB Entry DOI: 10.7270/Q28K7C79 |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM50211266
(CHEMBL3906477)Show SMILES O=C(N1CCCC[C@@H]1Cc1ccccc1)n1cc(nn1)-c1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C27H26N4O/c32-27(30-18-8-7-13-25(30)19-21-9-3-1-4-10-21)31-20-26(28-29-31)24-16-14-23(15-17-24)22-11-5-2-6-12-22/h1-6,9-12,14-17,20,25H,7-8,13,18-19H2/t25-/m1/s1 | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | CHEMBL4279328
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More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM50211266
(CHEMBL3906477)Show SMILES O=C(N1CCCC[C@@H]1Cc1ccccc1)n1cc(nn1)-c1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C27H26N4O/c32-27(30-18-8-7-13-25(30)19-21-9-3-1-4-10-21)31-20-26(28-29-31)24-16-14-23(15-17-24)22-11-5-2-6-12-22/h1-6,9-12,14-17,20,25H,7-8,13,18-19H2/t25-/m1/s1 | PDB
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Leiden University
Curated by ChEMBL
| Assay Description
Inhibition of human ABHD6 using 2-AG as natural substrate by fluorescence based assay |
J Med Chem 60: 428-440 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01482
BindingDB Entry DOI: 10.7270/Q28K7C79 |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM50211257
(CHEMBL3895863 | US10583137, Compound 14)Show SMILES OC(c1cnn(n1)C(=O)N1C[C@@H](CC[C@@H]1Cc1ccccc1)OCC#C)(c1ccc(F)cc1)c1ccc(F)cc1 |r| Show InChI InChI=1S/C31H28F2N4O3/c1-2-18-40-28-17-16-27(19-22-6-4-3-5-7-22)36(21-28)30(38)37-34-20-29(35-37)31(39,23-8-12-25(32)13-9-23)24-10-14-26(33)15-11-24/h1,3-15,20,27-28,39H,16-19,21H2/t27-,28-/m1/s1 | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM434879
(US10583137, Compound 17 | tert-Butyl 3-benzyl-4-(4...)Show SMILES CC(C)(C)OC(=O)N1CCN(C(Cc2ccccc2)C1)C(=O)n1cc(nn1)-c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C26H28F3N5O4/c1-25(2,3)38-24(36)32-13-14-33(20(16-32)15-18-7-5-4-6-8-18)23(35)34-17-22(30-31-34)19-9-11-21(12-10-19)37-26(27,28)29/h4-12,17,20H,13-16H2,1-3H3 | PDB
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Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010337
(CHEMBL3263582)Show SMILES OC(=O)c1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1Cc1ccccc1 Show InChI InChI=1S/C28H26N4O3/c33-27(34)24-10-6-9-23(18-24)21-12-14-22(15-13-21)26-19-32(30-29-26)28(35)31-16-5-4-11-25(31)17-20-7-2-1-3-8-20/h1-3,6-10,12-15,18-19,25H,4-5,11,16-17H2,(H,33,34) | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant mouse ABHD6 expressed in HEK293T using 2-arachidonoylglycerol preincubated for 30 mins followed by substrate addition measu... |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6 [33-337]
(Homo sapiens (Human)) | BDBM645020
(US20240010658, Example 3)Show SMILES CN1c2cc(sc2CCC1=O)C(=O)N1C[C@@H]2CC[C@@H](Nc3ccc(Br)nn3)[C@@H]2C1 |r| | PDB
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More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50052781
(CHEMBL3318603)Show InChI InChI=1S/C19H20N4O/c24-19(23-9-3-8-20-23)22-12-10-21(11-13-22)15-16-6-7-17-4-1-2-5-18(17)14-16/h1-9,14H,10-13,15H2 | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of FP-rhodamine probe binding to ABHD6 in mouse brain membrane proteome preincubated for 1 hr followed by FP-rhodamine addition and measur... |
Bioorg Med Chem 27: 1693-1703 (2019)
Article DOI: 10.1016/j.bmc.2019.03.020
BindingDB Entry DOI: 10.7270/Q2RX9GCW |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50052768
(CHEMBL3318613)Show SMILES O=C(N1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1)n1cc(cn1)C#N Show InChI InChI=1S/C23H23N5O2/c24-14-21-15-25-28(17-21)23(29)27-12-10-26(11-13-27)16-19-6-8-22(9-7-19)30-18-20-4-2-1-3-5-20/h1-9,15,17H,10-13,16,18H2 | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of FP-rhodamine probe binding to ABHD6 in mouse brain membrane proteome preincubated for 1 hr followed by FP-rhodamine addition and measur... |
Bioorg Med Chem 27: 1693-1703 (2019)
Article DOI: 10.1016/j.bmc.2019.03.020
BindingDB Entry DOI: 10.7270/Q2RX9GCW |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50052783
(CHEMBL3318605)Show InChI InChI=1S/C20H19N5O/c21-12-17-13-22-25(15-17)20(26)24-9-7-23(8-10-24)14-16-5-6-18-3-1-2-4-19(18)11-16/h1-6,11,13,15H,7-10,14H2 | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of FP-rhodamine probe binding to ABHD6 in mouse brain membrane proteome preincubated for 1 hr followed by FP-rhodamine addition and measur... |
Bioorg Med Chem 27: 1693-1703 (2019)
Article DOI: 10.1016/j.bmc.2019.03.020
BindingDB Entry DOI: 10.7270/Q2RX9GCW |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50052767
(CHEMBL3318612)Show SMILES Cc1cnn(c1)C(=O)N1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1 Show InChI InChI=1S/C23H26N4O2/c1-19-15-24-27(16-19)23(28)26-13-11-25(12-14-26)17-20-7-9-22(10-8-20)29-18-21-5-3-2-4-6-21/h2-10,15-16H,11-14,17-18H2,1H3 | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of FP-rhodamine probe binding to ABHD6 in mouse brain membrane proteome preincubated for 1 hr followed by FP-rhodamine addition and measur... |
Bioorg Med Chem 27: 1693-1703 (2019)
Article DOI: 10.1016/j.bmc.2019.03.020
BindingDB Entry DOI: 10.7270/Q2RX9GCW |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50052782
(CHEMBL3318604)Show InChI InChI=1S/C20H22N4O/c1-16-13-21-24(14-16)20(25)23-10-8-22(9-11-23)15-17-6-7-18-4-2-3-5-19(18)12-17/h2-7,12-14H,8-11,15H2,1H3 | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of FP-rhodamine probe binding to ABHD6 in mouse brain membrane proteome preincubated for 1 hr followed by FP-rhodamine addition and measur... |
Bioorg Med Chem 27: 1693-1703 (2019)
Article DOI: 10.1016/j.bmc.2019.03.020
BindingDB Entry DOI: 10.7270/Q2RX9GCW |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Homo sapiens (Human)) | BDBM24567
((2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-...)Show SMILES CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O |r| Show InChI InChI=1S/C29H53NO5/c1-5-7-9-11-12-13-14-15-16-18-24(34-29(33)26(30-22-31)20-23(3)4)21-27-25(28(32)35-27)19-17-10-8-6-2/h22-27H,5-21H2,1-4H3,(H,30,31)/t24-,25-,26-,27-/m0/s1 | PDB
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University of Eastern Finland
Curated by ChEMBL
| Assay Description
Inhibition of human ABHD6 expressed in HEK293 cells at 1 uM pre-incubated for 10 mins before 2-AG substrate addition followed by rapid 40 fold compou... |
Bioorg Med Chem 23: 6335-45 (2015)
Article DOI: 10.1016/j.bmc.2015.08.030
BindingDB Entry DOI: 10.7270/Q2NP266B |
More data for this
Ligand-Target Pair | |
Monoacylglycerol lipase ABHD6
(Mus musculus (mouse)) | BDBM50010336
(CHEMBL3263579)Show SMILES O=C(N1CCCCC1)c1cccc(c1)-c1ccc(cc1)-c1cn(nn1)C(=O)N1CCCCC1c1ccccc1 Show InChI InChI=1S/C32H33N5O2/c38-31(35-19-6-2-7-20-35)28-13-9-12-27(22-28)24-15-17-25(18-16-24)29-23-37(34-33-29)32(39)36-21-8-5-14-30(36)26-10-3-1-4-11-26/h1,3-4,9-13,15-18,22-23,30H,2,5-8,14,19-21H2 | PDB
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The Scripps Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant mouse ABHD6 expressed in HEK293T using 2-arachidonoylglycerol preincubated for 30 mins followed by substrate addition measu... |
Cell Chem Biol 56: 8270-9 (2013)
Article DOI: 10.1021/jm400899c
BindingDB Entry DOI: 10.7270/Q2WM1FXR |
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Ligand-Target Pair | |
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