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PubMed code 19464901

Compile data set for download or QSAR
Found 77 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
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298360
PNG
((R)-1-(7-ethyl-1H-furo[2,3-g]indazol-1-yl)propan-2...)
Show SMILES CCc1cc2c(ccc3cnn(C[C@@H](C)N)c23)o1
Show InChI InChI=1S/C14H17N3O/c1-3-11-6-12-13(18-11)5-4-10-7-16-17(14(10)12)8-9(2)15/h4-7,9H,3,8,15H2,1-2H3/t9-/m1/s1
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0.890n/an/an/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT2C receptor


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50257963
PNG
(2-(3-chlorobenzyloxy)-6-(piperazin-1-yl)pyrazine |...)
Show SMILES Clc1cccc(COc2cncc(n2)N2CCNCC2)c1
Show InChI InChI=1S/C15H17ClN4O/c16-13-3-1-2-12(8-13)11-21-15-10-18-9-14(19-15)20-6-4-17-5-7-20/h1-3,8-10,17H,4-7,11H2
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1n/an/an/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT2C receptor


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298361
PNG
((R)-1-(6-chloro-5-fluoro-1H-indol-1-yl)propan-2-am...)
Show SMILES C[C@@H](N)Cn1ccc2cc(F)c(Cl)cc12
Show InChI InChI=1S/C11H12ClFN2/c1-7(14)6-15-3-2-8-4-10(13)9(12)5-11(8)15/h2-5,7H,6,14H2,1H3/t7-/m1/s1
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1n/an/an/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT2C receptor


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298362
PNG
((R)-3-methyl-1-(4-(trifluoromethyl)-2,3-dihydroben...)
Show SMILES C[C@@H]1CN(CCN1)c1ccc(c2ccoc12)C(F)(F)F
Show InChI InChI=1S/C14H15F3N2O/c1-9-8-19(6-5-18-9)12-3-2-11(14(15,16)17)10-4-7-20-13(10)12/h2-4,7,9,18H,5-6,8H2,1H3/t9-/m1/s1
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2.40n/an/an/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT2C receptor


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50091831
PNG
((R)-8,9-Dichloro-2,3,4,4a-tetrahydro-1H,6H-pyrazin...)
Show SMILES Clc1cc2NC(=O)[C@H]3CNCCN3c2cc1Cl
Show InChI InChI=1S/C11H11Cl2N3O/c12-6-3-8-9(4-7(6)13)16-2-1-14-5-10(16)11(17)15-8/h3-4,10,14H,1-2,5H2,(H,15,17)/t10-/m1/s1
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3.30n/an/an/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT2C receptor


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50179073
PNG
((4R,9aR)-6-Cyclopropylmethoxymethyl-4-methyl-1,2,3...)
Show SMILES C[C@@H]1CNC[C@H]2Cc3ccc(COCC4CC4)nc3N12
Show InChI InChI=1S/C16H23N3O/c1-11-7-17-8-15-6-13-4-5-14(18-16(13)19(11)15)10-20-9-12-2-3-12/h4-5,11-12,15,17H,2-3,6-10H2,1H3/t11-,15-/m1/s1
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4n/an/an/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT2C receptor


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298359
PNG
((8aR,12aS)-2-(2,6-difluorophenyl)-6,7,8a,9,10,11,1...)
Show SMILES Fc1cccc(F)c1-c1cc2[C@H]3CNCC[C@H]3N3CCCSc(c1)c23
Show InChI InChI=1S/C20H20F2N2S/c21-15-3-1-4-16(22)19(15)12-9-13-14-11-23-6-5-17(14)24-7-2-8-25-18(10-12)20(13)24/h1,3-4,9-10,14,17,23H,2,5-8,11H2/t14-,17-/m1/s1
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5.20n/an/an/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT2C receptor


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50184597
PNG
((3aS,6aS)-5-(4-(2,5-dichlorophenyl)pyrimidin-2-yl)...)
Show SMILES Clc1ccc(Cl)c(c1)-c1ccnc(n1)N1C[C@@H]2CCN[C@@H]2C1
Show InChI InChI=1S/C16H16Cl2N4/c17-11-1-2-13(18)12(7-11)14-4-6-20-16(21-14)22-8-10-3-5-19-15(10)9-22/h1-2,4,6-7,10,15,19H,3,5,8-9H2/t10-,15+/m0/s1
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>2.00E+4n/an/an/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT2C receptor


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298309
PNG
(CHEMBL574533 | ETP-7146 | N-(3-methoxyphenyl)-1-me...)
Show SMILES COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCN(C)CC2)c1
Show InChI InChI=1S/C18H23N7O/c1-23-7-9-25(10-8-23)18-21-16(15-12-19-24(2)17(15)22-18)20-13-5-4-6-14(11-13)26-3/h4-6,11-12H,7-10H2,1-3H3,(H,20,21,22)
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n/an/a 7.80n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298354
PNG
(CHEMBL578653 | N-(4-fluorophenyl)-1-methyl-6-(4-me...)
Show SMILES CN1CCN(CC1)c1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C17H20FN7/c1-23-7-9-25(10-8-23)17-21-15(14-11-19-24(2)16(14)22-17)20-13-5-3-12(18)4-6-13/h3-6,11H,7-10H2,1-2H3,(H,20,21,22)
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n/an/a 20.1n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298310
PNG
(CHEMBL584389 | N-(4-chlorophenyl)-1-methyl-6-(4-me...)
Show SMILES CN1CCN(CC1)c1nc(Nc2ccc(Cl)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C17H20ClN7/c1-23-7-9-25(10-8-23)17-21-15(14-11-19-24(2)16(14)22-17)20-13-5-3-12(18)4-6-13/h3-6,11H,7-10H2,1-2H3,(H,20,21,22)
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n/an/a 29.4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298311
PNG
(1-methyl-6-(4-methylpiperazin-1-yl)-N-phenyl-1H-py...)
Show SMILES CN1CCN(CC1)c1nc(Nc2ccccc2)c2cnn(C)c2n1
Show InChI InChI=1S/C17H21N7/c1-22-8-10-24(11-9-22)17-20-15(19-13-6-4-3-5-7-13)14-12-18-23(2)16(14)21-17/h3-7,12H,8-11H2,1-2H3,(H,19,20,21)
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n/an/a 86.9n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298312
PNG
(CHEMBL572664 | N-(4-fluorophenyl)-6-(4-(4-fluoroph...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(nc12)N1CCN(CC1)c1ccc(F)cc1
Show InChI InChI=1S/C22H21F2N7/c1-29-21-19(14-25-29)20(26-17-6-2-15(23)3-7-17)27-22(28-21)31-12-10-30(11-13-31)18-8-4-16(24)5-9-18/h2-9,14H,10-13H2,1H3,(H,26,27,28)
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n/an/a 148n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298355
PNG
(CHEMBL573835 | N-(2-(dimethylamino)ethyl)-5-(1H-in...)
Show SMILES CN(C)CCNC(=O)c1ccc(s1)-n1ccc2ccccc12
Show InChI InChI=1S/C17H19N3OS/c1-19(2)12-10-18-17(21)15-7-8-16(22-15)20-11-9-13-5-3-4-6-14(13)20/h3-9,11H,10,12H2,1-2H3,(H,18,21)
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n/an/a 222n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298313
PNG
(CHEMBL574769 | N6,N6-diethyl-1-methyl-N4-o-tolyl-1...)
Show SMILES CCN(CC)c1nc(Nc2ccccc2C)c2cnn(C)c2n1
Show InChI InChI=1S/C17H22N6/c1-5-23(6-2)17-20-15(13-11-18-22(4)16(13)21-17)19-14-10-8-7-9-12(14)3/h7-11H,5-6H2,1-4H3,(H,19,20,21)
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n/an/a 242n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298314
PNG
(CHEMBL574980 | N-(4-fluorophenyl)-1-methyl-6-(4-ph...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(nc12)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C22H22FN7/c1-28-21-19(15-24-28)20(25-17-9-7-16(23)8-10-17)26-22(27-21)30-13-11-29(12-14-30)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3,(H,25,26,27)
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n/an/a 416n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298334
PNG
(CHEMBL583787 | N-(2-(dimethylamino)ethyl)-1H-indol...)
Show SMILES CN(C)CCNC(=O)c1cc2ccccc2[nH]1
Show InChI InChI=1S/C13H17N3O/c1-16(2)8-7-14-13(17)12-9-10-5-3-4-6-11(10)15-12/h3-6,9,15H,7-8H2,1-2H3,(H,14,17)
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n/an/a 424n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298315
PNG
(2-(4-(4-(4-fluorophenylamino)-1-methyl-1H-pyrazolo...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(nc12)N1CCN(CCO)CC1
Show InChI InChI=1S/C18H22FN7O/c1-24-17-15(12-20-24)16(21-14-4-2-13(19)3-5-14)22-18(23-17)26-8-6-25(7-9-26)10-11-27/h2-5,12,27H,6-11H2,1H3,(H,21,22,23)
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n/an/a 494n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298335
PNG
(CHEMBL573553 | methyl 4-hydroxy-2-(piperidin-4-yl)...)
Show SMILES COC(=O)c1cnn2c1nc([nH]c2=O)C1CCNCC1
Show InChI InChI=1S/C12H15N5O3/c1-20-11(18)8-6-14-17-10(8)15-9(16-12(17)19)7-2-4-13-5-3-7/h6-7,13H,2-5H2,1H3,(H,15,16,19)
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n/an/a 589n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298316
PNG
(6-(4-benzylpiperazin-1-yl)-N-(4-fluorophenyl)-1-me...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(nc12)N1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C23H24FN7/c1-29-22-20(15-25-29)21(26-19-9-7-18(24)8-10-19)27-23(28-22)31-13-11-30(12-14-31)16-17-5-3-2-4-6-17/h2-10,15H,11-14,16H2,1H3,(H,26,27,28)
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n/an/a 836n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298317
PNG
(CHEMBL584205 | N4-(4-chlorophenyl)-N6,N6-diethyl-1...)
Show SMILES CCN(CC)c1nc(Nc2ccc(Cl)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C16H19ClN6/c1-4-23(5-2)16-20-14(13-10-18-22(3)15(13)21-16)19-12-8-6-11(17)7-9-12/h6-10H,4-5H2,1-3H3,(H,19,20,21)
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n/an/a 991n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298318
PNG
(6-(4-(4-fluorophenyl)piperazin-1-yl)-N-(3-methoxyp...)
Show SMILES COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCN(CC2)c2ccc(F)cc2)c1
Show InChI InChI=1S/C23H24FN7O/c1-29-22-20(15-25-29)21(26-17-4-3-5-19(14-17)32-2)27-23(28-22)31-12-10-30(11-13-31)18-8-6-16(24)7-9-18/h3-9,14-15H,10-13H2,1-2H3,(H,26,27,28)
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n/an/a 1.09E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298319
PNG
(6-(4-(4-fluorophenyl)piperazin-1-yl)-N-(4-methoxyp...)
Show SMILES COc1ccc(Nc2nc(nc3n(C)ncc23)N2CCN(CC2)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C23H24FN7O/c1-29-22-20(15-25-29)21(26-17-5-9-19(32-2)10-6-17)27-23(28-22)31-13-11-30(12-14-31)18-7-3-16(24)4-8-18/h3-10,15H,11-14H2,1-2H3,(H,26,27,28)
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n/an/a 1.18E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298320
PNG
(CHEMBL584575 | N-(4-fluorophenyl)-1-methyl-6-(pipe...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(nc12)N1CCCCC1
Show InChI InChI=1S/C17H19FN6/c1-23-16-14(11-19-23)15(20-13-7-5-12(18)6-8-13)21-17(22-16)24-9-3-2-4-10-24/h5-8,11H,2-4,9-10H2,1H3,(H,20,21,22)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298321
PNG
(CHEMBL574098 | N-(4-fluorophenyl)-1-methyl-6-(4-me...)
Show SMILES CC1CCN(CC1)c1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C18H21FN6/c1-12-7-9-25(10-8-12)18-22-16(15-11-20-24(2)17(15)23-18)21-14-5-3-13(19)4-6-14/h3-6,11-12H,7-10H2,1-2H3,(H,21,22,23)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298322
PNG
(CHEMBL578225 | N-(4-fluorophenyl)-6-(4-(2-methoxyp...)
Show SMILES COc1ccccc1N1CCN(CC1)c1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C23H24FN7O/c1-29-22-18(15-25-29)21(26-17-9-7-16(24)8-10-17)27-23(28-22)31-13-11-30(12-14-31)19-5-3-4-6-20(19)32-2/h3-10,15H,11-14H2,1-2H3,(H,26,27,28)
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n/an/a 1.73E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298336
PNG
(CHEMBL574253 | N-(2-(dimethylamino)ethyl)-N-(4-flu...)
Show SMILES CN(C)CCN(C(C)=O)c1nc2c(F)cccc2s1
Show InChI InChI=1S/C13H16FN3OS/c1-9(18)17(8-7-16(2)3)13-15-12-10(14)5-4-6-11(12)19-13/h4-6H,7-8H2,1-3H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298337
PNG
(CHEMBL575812 | ethyl 4-(4-methylpiperazin-1-yl)iso...)
Show SMILES CCOC(=O)c1noc2ncnc(N3CCN(C)CC3)c12
Show InChI InChI=1S/C13H17N5O3/c1-3-20-13(19)10-9-11(14-8-15-12(9)21-16-10)18-6-4-17(2)5-7-18/h8H,3-7H2,1-2H3
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n/an/a 2.05E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298323
PNG
(CHEMBL577181 | N-(4-fluorophenyl)-1-methyl-6-morph...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(nc12)N1CCOCC1
Show InChI InChI=1S/C16H17FN6O/c1-22-15-13(10-18-22)14(19-12-4-2-11(17)3-5-12)20-16(21-15)23-6-8-24-9-7-23/h2-5,10H,6-9H2,1H3,(H,19,20,21)
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n/an/a 2.07E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298324
PNG
(CHEMBL574749 | N6-benzyl-N4-(4-fluorophenyl)-1-met...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(NCc3ccccc3)nc12
Show InChI InChI=1S/C19H17FN6/c1-26-18-16(12-22-26)17(23-15-9-7-14(20)8-10-15)24-19(25-18)21-11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H2,21,23,24,25)
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n/an/a 2.59E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298338
PNG
(CHEMBL573317 | N-(2-Dimethylamino-ethyl)-N-[1,3]di...)
Show SMILES CN(C)CCN(C(C)=O)c1nc2cc3OCOc3cc2s1
Show InChI InChI=1S/C14H17N3O3S/c1-9(18)17(5-4-16(2)3)14-15-10-6-11-12(20-8-19-11)7-13(10)21-14/h6-7H,4-5,8H2,1-3H3
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n/an/a 2.73E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298363
PNG
(CHEMBL583777 | N6,N6-diethyl-N4-(4-fluorophenyl)-1...)
Show SMILES CCN(CC)c1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C16H19FN6/c1-4-23(5-2)16-20-14(13-10-18-22(3)15(13)21-16)19-12-8-6-11(17)7-9-12/h6-10H,4-5H2,1-3H3,(H,19,20,21)
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n/an/a 3.31E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298364
PNG
(6-(3,5-dimethylpiperidin-1-yl)-N-(4-fluorophenyl)-...)
Show SMILES CC1CC(C)CN(C1)c1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C19H23FN6/c1-12-8-13(2)11-26(10-12)19-23-17(16-9-21-25(3)18(16)24-19)22-15-6-4-14(20)5-7-15/h4-7,9,12-13H,8,10-11H2,1-3H3,(H,22,23,24)
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n/an/a 3.82E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298365
PNG
(CHEMBL575848 | N4-(4-fluorophenyl)-N6,N6,1-trimeth...)
Show SMILES CN(C)c1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C14H15FN6/c1-20(2)14-18-12(11-8-16-21(3)13(11)19-14)17-10-6-4-9(15)5-7-10/h4-8H,1-3H3,(H,17,18,19)
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n/an/a 4.03E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298356
PNG
(CHEMBL575852 | ethyl 4-(2-(butyl(methyl)amino)ethy...)
Show SMILES CCCCN(C)CCNc1nc(C)nc2oc(C)c(C(=O)OCC)c12
Show InChI InChI=1S/C18H28N4O3/c1-6-8-10-22(5)11-9-19-16-15-14(18(23)24-7-2)12(3)25-17(15)21-13(4)20-16/h6-11H2,1-5H3,(H,19,20,21)
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n/an/a 4.17E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298357
PNG
(CHEMBL574080 | ethyl 4-(2-(dimethylamino)ethylamin...)
Show SMILES CCOC(=O)c1ccc2nc(C)[nH]c(NCCN(C)C)c12
Show InChI InChI=1S/C15H22N4O2/c1-5-21-15(20)11-6-7-12-13(11)14(18-10(2)17-12)16-8-9-19(3)4/h6-7,16H,5,8-9H2,1-4H3,(H,17,18)
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n/an/a 4.48E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50015768
PNG
((1-Ethyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)-me...)
Show SMILES CCc1nnc2c(NC)nc3ccccc3n12
Show InChI InChI=1S/C12H13N5/c1-3-10-15-16-12-11(13-2)14-8-6-4-5-7-9(8)17(10)12/h4-7H,3H2,1-2H3,(H,13,14)
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n/an/a 5.11E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298339
PNG
(CHEMBL575603 | N-(2-(4-methylpiperazine-1-carbonyl...)
Show SMILES CN1CCN(CC1)C(=O)c1oc2ccccc2c1NC(C)=O
Show InChI InChI=1S/C16H19N3O3/c1-11(20)17-14-12-5-3-4-6-13(12)22-15(14)16(21)19-9-7-18(2)8-10-19/h3-6H,7-10H2,1-2H3,(H,17,20)
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n/an/a 5.29E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298366
PNG
(CHEMBL574984 | N6,N6-diethyl-N4-(3-methoxyphenyl)-...)
Show SMILES CCN(CC)c1nc(Nc2cccc(OC)c2)c2cnn(C)c2n1
Show InChI InChI=1S/C17H22N6O/c1-5-23(6-2)17-20-15(14-11-18-22(3)16(14)21-17)19-12-8-7-9-13(10-12)24-4/h7-11H,5-6H2,1-4H3,(H,19,20,21)
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n/an/a 5.42E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298340
PNG
(CHEMBL574532 | N-((2-ethylisoindolin-4-yl)methyl)-...)
Show SMILES CCN1Cc2cccc(CNc3ccc(C)c(F)c3)c2C1
Show InChI InChI=1S/C18H21FN2/c1-3-21-11-15-6-4-5-14(17(15)12-21)10-20-16-8-7-13(2)18(19)9-16/h4-9,20H,3,10-12H2,1-2H3
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n/an/a 5.63E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298367
PNG
(CHEMBL584187 | N6-cyclohexyl-N4-(4-fluorophenyl)-1...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(NC3CCCCC3)nc12
Show InChI InChI=1S/C18H21FN6/c1-25-17-15(11-20-25)16(21-14-9-7-12(19)8-10-14)23-18(24-17)22-13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H2,21,22,23,24)
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n/an/a 5.71E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298368
PNG
(CHEMBL576552 | N4-(4-fluorophenyl)-1-methyl-N6-(4-...)
Show SMILES Cc1ccc(CNc2nc(Nc3ccc(F)cc3)c3cnn(C)c3n2)cc1
Show InChI InChI=1S/C20H19FN6/c1-13-3-5-14(6-4-13)11-22-20-25-18(17-12-23-27(2)19(17)26-20)24-16-9-7-15(21)8-10-16/h3-10,12H,11H2,1-2H3,(H2,22,24,25,26)
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n/an/a 5.83E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298369
PNG
(CHEMBL573305 | N4-(4-fluorophenyl)-N6,1-dimethyl-1...)
Show SMILES CNc1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C13H13FN6/c1-15-13-18-11(10-7-16-20(2)12(10)19-13)17-9-5-3-8(14)4-6-9/h3-7H,1-2H3,(H2,15,17,18,19)
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n/an/a 7.79E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298370
PNG
(CHEMBL573862 | N4-(3,4-dimethylphenyl)-N6,N6-dieth...)
Show SMILES CCN(CC)c1nc(Nc2ccc(C)c(C)c2)c2cnn(C)c2n1
Show InChI InChI=1S/C18H24N6/c1-6-24(7-2)18-21-16(15-11-19-23(5)17(15)22-18)20-14-9-8-12(3)13(4)10-14/h8-11H,6-7H2,1-5H3,(H,20,21,22)
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n/an/a 8.49E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298358
PNG
(4-methyl-N-((5-methylbenzo[d]isoxazol-3-yl)methyl)...)
Show SMILES CN1CCN(CC1)C(=O)NCc1noc2ccc(C)cc12
Show InChI InChI=1S/C15H20N4O2/c1-11-3-4-14-12(9-11)13(17-21-14)10-16-15(20)19-7-5-18(2)6-8-19/h3-4,9H,5-8,10H2,1-2H3,(H,16,20)
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n/an/a 8.93E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298341
PNG
(CHEMBL564497 | N-(3-m-tolyl-[1,2,4]triazolo[3,4-b]...)
Show SMILES CCC(=O)Nc1nn2c(nnc2s1)-c1cccc(C)c1
Show InChI InChI=1S/C13H13N5OS/c1-3-10(19)14-12-17-18-11(15-16-13(18)20-12)9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3,(H,14,17,19)
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n/an/a 9.22E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298304
PNG
(CHEMBL579267 | ethyl 6-methyl-4-(2-morpholinoethyl...)
Show SMILES CCOC(=O)c1c(C)oc2ncnc(NCCN3CCOCC3)c12
Show InChI InChI=1S/C16H22N4O4/c1-3-23-16(21)12-11(2)24-15-13(12)14(18-10-19-15)17-4-5-20-6-8-22-9-7-20/h10H,3-9H2,1-2H3,(H,17,18,19)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298305
PNG
(1-(2-(diethylamino)ethyl)-N-(pyridin-4-ylmethyl)-1...)
Show SMILES CCN(CC)CCn1c(NCc2ccncc2)nc2ccccc12
Show InChI InChI=1S/C19H25N5/c1-3-23(4-2)13-14-24-18-8-6-5-7-17(18)22-19(24)21-15-16-9-11-20-12-10-16/h5-12H,3-4,13-15H2,1-2H3,(H,21,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298306
PNG
(3-methyl-N-(3-o-tolyl-[1,2,4]triazolo[3,4-b][1,3,4...)
Show SMILES Cc1cccc(c1)C(=O)Nc1nn2c(nnc2s1)-c1ccccc1C
Show InChI InChI=1S/C18H15N5OS/c1-11-6-5-8-13(10-11)16(24)19-17-22-23-15(20-21-18(23)25-17)14-9-4-3-7-12(14)2/h3-10H,1-2H3,(H,19,22,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298329
PNG
(CHEMBL574327 | N4-(4-fluorophenyl)-N6-(2-methoxyet...)
Show SMILES COCCNc1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C15H17FN6O/c1-22-14-12(9-18-22)13(19-11-5-3-10(16)4-6-11)20-15(21-14)17-7-8-23-2/h3-6,9H,7-8H2,1-2H3,(H2,17,19,20,21)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298353
PNG
(4-chloro-3-methyl-N-(2-morpholinoethyl)isoxazole-5...)
Show SMILES Cc1noc(C(=O)NCCN2CCOCC2)c1Cl
Show InChI InChI=1S/C11H16ClN3O3/c1-8-9(12)10(18-14-8)11(16)13-2-3-15-4-6-17-7-5-15/h2-7H2,1H3,(H,13,16)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298302
PNG
(CHEMBL572661 | N-(2-cyclohexenylethyl)-1-ethyl-[1,...)
Show SMILES CCc1nnc2c(NCCC3=CCCCC3)nc3ccccc3n12
Show InChI InChI=1S/C19H23N5/c1-2-17-22-23-19-18(20-13-12-14-8-4-3-5-9-14)21-15-10-6-7-11-16(15)24(17)19/h6-8,10-11H,2-5,9,12-13H2,1H3,(H,20,21)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298327
PNG
(CHEMBL574099 | N6-ethyl-N4-(4-fluorophenyl)-1-meth...)
Show SMILES CCNc1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C14H15FN6/c1-3-16-14-19-12(11-8-17-21(2)13(11)20-14)18-10-6-4-9(15)5-7-10/h4-8H,3H2,1-2H3,(H2,16,18,19,20)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298342
PNG
(3-methyl-N-(2-morpholinoethyl)isoxazole-5-carboxam...)
Show SMILES Cc1cc(on1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C11H17N3O3/c1-9-8-10(17-13-9)11(15)12-2-3-14-4-6-16-7-5-14/h8H,2-7H2,1H3,(H,12,15)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298343
PNG
(8-methyl-N-propyltetrazolo[1,5-a]quinoxalin-4-amin...)
Show SMILES CCCNc1nc2ccc(C)cc2n2nnnc12
Show InChI InChI=1S/C12H14N6/c1-3-6-13-11-12-15-16-17-18(12)10-7-8(2)4-5-9(10)14-11/h4-5,7H,3,6H2,1-2H3,(H,13,14)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298349
PNG
((S)-7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrid...)
Show SMILES COc1ccc2c3CCN[C@](C)(C(O)=O)c3[nH]c2c1
Show InChI InChI=1S/C14H16N2O3/c1-14(13(17)18)12-10(5-6-15-14)9-4-3-8(19-2)7-11(9)16-12/h3-4,7,15-16H,5-6H2,1-2H3,(H,17,18)/t14-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298352
PNG
(CHEMBL564496 | N-o-tolylhexahydro-1H-pyrido[1,2-a]...)
Show SMILES Cc1ccccc1NC(=O)N1CCN2CCCCC2C1
Show InChI InChI=1S/C16H23N3O/c1-13-6-2-3-8-15(13)17-16(20)19-11-10-18-9-5-4-7-14(18)12-19/h2-3,6,8,14H,4-5,7,9-12H2,1H3,(H,17,20)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298307
PNG
(1,3-dimethyl-5-((2-morpholinoethylamino)methyl)-1H...)
Show SMILES Cn1c2ccc(CNCCN3CCOCC3)cc2n(C)c1=O
Show InChI InChI=1S/C16H24N4O2/c1-18-14-4-3-13(11-15(14)19(2)16(18)21)12-17-5-6-20-7-9-22-10-8-20/h3-4,11,17H,5-10,12H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298333
PNG
(CHEMBL573538 | N4-(4-fluorophenyl)-1-methyl-N6-(2-...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(NCCN3CCOCC3)nc12
Show InChI InChI=1S/C18H22FN7O/c1-25-17-15(12-21-25)16(22-14-4-2-13(19)3-5-14)23-18(24-17)20-6-7-26-8-10-27-11-9-26/h2-5,12H,6-11H2,1H3,(H2,20,22,23,24)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298344
PNG
(3-(3,4-dimethylphenyl)-1,4,8-triazaspiro[4.5]dec-3...)
Show SMILES Cc1ccc(cc1C)C1=NC2(CCNCC2)NC1=O
Show InChI InChI=1S/C15H19N3O/c1-10-3-4-12(9-11(10)2)13-14(19)18-15(17-13)5-7-16-8-6-15/h3-4,9,16H,5-8H2,1-2H3,(H,18,19)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298345
PNG
(CHEMBL572430 | N-(2-(dimethylamino)ethyl)-3-(pyrid...)
Show SMILES CN(C)CCNC(=O)c1nc(no1)-c1cccnc1
Show InChI InChI=1S/C12H15N5O2/c1-17(2)7-6-14-11(18)12-15-10(16-19-12)9-4-3-5-13-8-9/h3-5,8H,6-7H2,1-2H3,(H,14,18)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298347
PNG
(3-methyl-N-(2-morpholinoethyl)isoxazolo[5,4-d]pyri...)
Show SMILES Cc1noc2ncnc(NCCN3CCOCC3)c12
Show InChI InChI=1S/C12H17N5O2/c1-9-10-11(14-8-15-12(10)19-16-9)13-2-3-17-4-6-18-7-5-17/h8H,2-7H2,1H3,(H,13,14,15)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298299
PNG
(CHEMBL574303 | N-(2-(4-methylpiperazin-1-yl)ethyl)...)
Show SMILES CN1CCN(CCNC(=O)c2cc3ccc4cccnc4c3[nH]2)CC1
Show InChI InChI=1S/C19H23N5O/c1-23-9-11-24(12-10-23)8-7-21-19(25)16-13-15-5-4-14-3-2-6-20-17(14)18(15)22-16/h2-6,13,22H,7-12H2,1H3,(H,21,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298350
PNG
(CHEMBL573597 | N-(2-ethylphenyl)-2-(3-oxopiperazin...)
Show SMILES CCc1ccccc1NC(=O)CC1NCCNC1=O
Show InChI InChI=1S/C14H19N3O2/c1-2-10-5-3-4-6-11(10)17-13(18)9-12-14(19)16-8-7-15-12/h3-6,12,15H,2,7-9H2,1H3,(H,16,19)(H,17,18)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298348
PNG
(CHEMBL574981 | N-(3,4-dimethylphenyl)hexahydro-1H-...)
Show SMILES Cc1ccc(NC(=O)N2CCN3CCCCC3C2)cc1C
Show InChI InChI=1S/C17H25N3O/c1-13-6-7-15(11-14(13)2)18-17(21)20-10-9-19-8-4-3-5-16(19)12-20/h6-7,11,16H,3-5,8-10,12H2,1-2H3,(H,18,21)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298326
PNG
(1-methyl-N4-phenyl-N6-propyl-1H-pyrazolo[3,4-d]pyr...)
Show SMILES CCCNc1nc(Nc2ccccc2)c2cnn(C)c2n1
Show InChI InChI=1S/C15H18N6/c1-3-9-16-15-19-13(18-11-7-5-4-6-8-11)12-10-17-21(2)14(12)20-15/h4-8,10H,3,9H2,1-2H3,(H2,16,18,19,20)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298325
PNG
(CHEMBL584574 | N6-ethyl-1-methyl-N4-phenyl-1H-pyra...)
Show SMILES CCNc1nc(Nc2ccccc2)c2cnn(C)c2n1
Show InChI InChI=1S/C14H16N6/c1-3-15-14-18-12(17-10-7-5-4-6-8-10)11-9-16-20(2)13(11)19-14/h4-9H,3H2,1-2H3,(H2,15,17,18,19)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298346
PNG
(2-(1-(3-methylbenzyl)-3-oxopiperazin-2-yl)acetic a...)
Show SMILES Cc1cccc(CN2CCNC(=O)C2CC(O)=O)c1
Show InChI InChI=1S/C14H18N2O3/c1-10-3-2-4-11(7-10)9-16-6-5-15-14(19)12(16)8-13(17)18/h2-4,7,12H,5-6,8-9H2,1H3,(H,15,19)(H,17,18)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298332
PNG
(CHEMBL574750 | N6-cyclopentyl-N4-(4-fluorophenyl)-...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(NC3CCCC3)nc12
Show InChI InChI=1S/C17H19FN6/c1-24-16-14(10-19-24)15(20-13-8-6-11(18)7-9-13)22-17(23-16)21-12-4-2-3-5-12/h6-10,12H,2-5H2,1H3,(H2,20,21,22,23)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298308
PNG
(3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-N-(2-morpholi...)
Show SMILES CCn1ncc(C2=NOC(C2)C(=O)NCCN2CCOCC2)c1C
Show InChI InChI=1S/C16H25N5O3/c1-3-21-12(2)13(11-18-21)14-10-15(24-19-14)16(22)17-4-5-20-6-8-23-9-7-20/h11,15H,3-10H2,1-2H3,(H,17,22)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298301
PNG
(2-cyclopropyl-7-((5-methyl-4H-1,2,4-triazol-3-ylth...)
Show SMILES Cc1nnc(SCc2cc(=O)n3nc(sc3n2)C2CC2)[nH]1
Show InChI InChI=1S/C12H12N6OS2/c1-6-13-11(16-15-6)20-5-8-4-9(19)18-12(14-8)21-10(17-18)7-2-3-7/h4,7H,2-3,5H2,1H3,(H,13,15,16)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298300
PNG
(4,5-Dihydro-thieno[3',2':3,4]benzo[1,2-d]isoxazole...)
Show SMILES CC1CCCCN1CCNC(=O)c1noc-2c1CCc1sccc-21
Show InChI InChI=1S/C18H23N3O2S/c1-12-4-2-3-9-21(12)10-8-19-18(22)16-14-5-6-15-13(7-11-24-15)17(14)23-20-16/h7,11-12H,2-6,8-10H2,1H3,(H,19,22)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298351
PNG
(8,9-dimethoxy-5,5-dimethyl-1,2,3,5,6,10b-hexahydro...)
Show SMILES COc1cc2CC(C)(C)N3CCCC3c2cc1OC
Show InChI InChI=1S/C16H23NO2/c1-16(2)10-11-8-14(18-3)15(19-4)9-12(11)13-6-5-7-17(13)16/h8-9,13H,5-7,10H2,1-4H3
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298330
PNG
(CHEMBL574547 | N4-(4-fluorophenyl)-N6-(3-methoxypr...)
Show SMILES COCCCNc1nc(Nc2ccc(F)cc2)c2cnn(C)c2n1
Show InChI InChI=1S/C16H19FN6O/c1-23-15-13(10-19-23)14(20-12-6-4-11(17)5-7-12)21-16(22-15)18-8-3-9-24-2/h4-7,10H,3,8-9H2,1-2H3,(H2,18,20,21,22)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298328
PNG
(3-(4-(4-fluorophenylamino)-1-methyl-1H-pyrazolo[3,...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(NCCCO)nc12
Show InChI InChI=1S/C15H17FN6O/c1-22-14-12(9-18-22)13(19-11-5-3-10(16)4-6-11)20-15(21-14)17-7-2-8-23/h3-6,9,23H,2,7-8H2,1H3,(H2,17,19,20,21)
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Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298331
PNG
(CHEMBL574548 | N6-allyl-N4-(4-fluorophenyl)-1-meth...)
Show SMILES Cn1ncc2c(Nc3ccc(F)cc3)nc(NCC=C)nc12
Show InChI InChI=1S/C15H15FN6/c1-3-8-17-15-20-13(12-9-18-22(2)14(12)21-15)19-11-6-4-10(16)5-7-11/h3-7,9H,1,8H2,2H3,(H2,17,19,20,21)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298303
PNG
(8-methyl-N-(4-methylphenethyl)tetrazolo[1,5-a]quin...)
Show SMILES Cc1ccc(CCNc2nc3ccc(C)cc3n3nnnc23)cc1
Show InChI InChI=1S/C18H18N6/c1-12-3-6-14(7-4-12)9-10-19-17-18-21-22-23-24(18)16-11-13(2)5-8-15(16)20-17/h3-8,11H,9-10H2,1-2H3,(H,19,20)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%