Compile Data Set for Download or QSAR
Found 502 with Last Name = 'lancelot' and Initial = 'jc'
TargetHistamine H3 receptor(GUINEA PIG)
Unité 109

Curated by PDSP Ki Database
LigandPNGBDBM22914(CHEMBL260374 | N-cyclohexyl-4-(1H-imidazol-5-yl)pi...)
Show SMILES S=C(NC1CCCCC1)N1CCC(CC1)c1cnc[nH]1
Show InChI InChI=1S/C15H24N4S/c20-15(18-13-4-2-1-3-5-13)19-8-6-12(7-9-19)14-10-16-11-17-14/h10-13H,1-9H2,(H,16,17)(H,18,20)
TargetHrh3 protein(RAT)
Unité 109

Curated by PDSP Ki Database
LigandPNGBDBM22914(CHEMBL260374 | N-cyclohexyl-4-(1H-imidazol-5-yl)pi...)
Show SMILES S=C(NC1CCCCC1)N1CCC(CC1)c1cnc[nH]1
Show InChI InChI=1S/C15H24N4S/c20-15(18-13-4-2-1-3-5-13)19-8-6-12(7-9-19)14-10-16-11-17-14/h10-13H,1-9H2,(H,16,17)(H,18,20)
Affinity DataKi:  2.10nMMore data for this Ligand-Target Pair
TargetHistamine H3 receptor(GUINEA PIG)
Unité 109

Curated by PDSP Ki Database
LigandPNGBDBM81974(4-[2-(1-Pyrrolidinyl)ethyl]-imidazole)
Show SMILES C(Cc1cnc[nH]1)N1CCCC1
Show InChI InChI=1S/C9H15N3/c1-2-5-12(4-1)6-3-9-7-10-8-11-9/h7-8H,1-6H2,(H,10,11)
TargetHrh3 protein(RAT)
Unité 109

Curated by PDSP Ki Database
LigandPNGBDBM81972((S)-(+)-ALPHA-METHYL-1H-IMIDAZOLE-4-ETHANAMINE DIH...)
Show SMILES C[C@H](N)Cc1cnc[nH]1
Show InChI InChI=1S/C6H11N3/c1-5(7)2-6-3-8-4-9-6/h3-5H,2,7H2,1H3,(H,8,9)/t5-/m0/s1
Affinity DataKi:  11nMMore data for this Ligand-Target Pair
TargetHistamine H3 receptor(GUINEA PIG)
Unité 109

Curated by PDSP Ki Database
LigandPNGBDBM81972((S)-(+)-ALPHA-METHYL-1H-IMIDAZOLE-4-ETHANAMINE DIH...)
Show SMILES C[C@H](N)Cc1cnc[nH]1
Show InChI InChI=1S/C6H11N3/c1-5(7)2-6-3-8-4-9-6/h3-5H,2,7H2,1H3,(H,8,9)/t5-/m0/s1
Affinity DataKi:  52nMMore data for this Ligand-Target Pair
TargetHrh3 protein(RAT)
Unité 109

Curated by PDSP Ki Database
LigandPNGBDBM7966(2-(1H-imidazol-4-yl)ethan-1-amine | CHEMBL544208 |...)
Show SMILES NCCc1cnc[nH]1
Show InChI InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8)
Affinity DataKi:  100nMMore data for this Ligand-Target Pair
TargetHistamine H3 receptor(GUINEA PIG)
Unité 109

Curated by PDSP Ki Database
LigandPNGBDBM7966(2-(1H-imidazol-4-yl)ethan-1-amine | CHEMBL544208 |...)
Show SMILES NCCc1cnc[nH]1
Show InChI InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8)
Affinity DataKi:  100nMMore data for this Ligand-Target Pair
TargetHistamine H3 receptor(GUINEA PIG)
Unité 109

Curated by PDSP Ki Database
LigandPNGBDBM22904((2R)-1-(1H-imidazol-5-yl)propan-2-amine | (R)-alph...)
Show SMILES C[C@@H](N)Cc1cnc[nH]1
Show InChI InChI=1S/C6H11N3/c1-5(7)2-6-3-8-4-9-6/h3-5H,2,7H2,1H3,(H,8,9)/t5-/m1/s1
Affinity DataKi:  813nMMore data for this Ligand-Target Pair
TargetHrh3 protein(RAT)
Unité 109

Curated by PDSP Ki Database
LigandPNGBDBM22904((2R)-1-(1H-imidazol-5-yl)propan-2-amine | (R)-alph...)
Show SMILES C[C@@H](N)Cc1cnc[nH]1
Show InChI InChI=1S/C6H11N3/c1-5(7)2-6-3-8-4-9-6/h3-5H,2,7H2,1H3,(H,8,9)/t5-/m1/s1
Affinity DataKi:  1.06E+3nMMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50058283(6-(4-Benzyl-piperazin-1-yl)-pyrido[3,2-e]pyrrolo[1...)
Show SMILES C(N1CCN(CC1)c1nc2cccnc2n2cccc12)c1ccccc1
Show InChI InChI=1S/C21H21N5/c1-2-6-17(7-3-1)16-24-12-14-25(15-13-24)21-19-9-5-11-26(19)20-18(23-21)8-4-10-22-20/h1-11H,12-16H2
Affinity DataIC50: 0.000813nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408165(CHEMBL299231)
Show SMILES C=CCN1CCN(CC1)c1nc2cccnc2n2cccc12
Show InChI InChI=1S/C17H19N5/c1-2-8-20-10-12-21(13-11-20)17-15-6-4-9-22(15)16-14(19-17)5-3-7-18-16/h2-7,9H,1,8,10-13H2
Affinity DataIC50: 0.00398nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408166(CHEMBL416662)
Show SMILES Clc1ccc2c(c1)nc(N1CCN(Cc3ccc4OCOc4c3)CC1)c1cccn21
Show InChI InChI=1S/C23H21ClN4O2/c24-17-4-5-19-18(13-17)25-23(20-2-1-7-28(19)20)27-10-8-26(9-11-27)14-16-3-6-21-22(12-16)30-15-29-21/h1-7,12-13H,8-11,14-15H2
Affinity DataIC50: 0.0813nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408162(CHEMBL299634)
Show SMILES Clc1ccc2c(c1)nc(N1CCN(Cc3ccccc3)CC1)c1cccn21
Show InChI InChI=1S/C22H21ClN4/c23-18-8-9-20-19(15-18)24-22(21-7-4-10-27(20)21)26-13-11-25(12-14-26)16-17-5-2-1-3-6-17/h1-10,15H,11-14,16H2
Affinity DataIC50: 0.288nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408167(CHEMBL53416)
Show SMILES C(N1CCN(CC1)c1nc2ccccc2n2cccc12)c1ccccc1
Show InChI InChI=1S/C22H22N4/c1-2-7-18(8-3-1)17-24-13-15-25(16-14-24)22-21-11-6-12-26(21)20-10-5-4-9-19(20)23-22/h1-12H,13-17H2
Affinity DataIC50: 0.355nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50014407(2-(piperazin-1-yl)quinoline | 2-Piperazin-1-yl-qui...)
Show SMILES C1CN(CCN1)c1ccc2ccccc2n1
Show InChI InChI=1S/C13H15N3/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2
Affinity DataIC50: 0.447nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50014407(2-(piperazin-1-yl)quinoline | 2-Piperazin-1-yl-qui...)
Show SMILES C1CN(CCN1)c1ccc2ccccc2n1
Show InChI InChI=1S/C13H15N3/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2
Affinity DataIC50: 0.447nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408168(CHEMBL49932)
Show SMILES C(N1CCN(CC1)c1nc2cccnc2n2cccc12)c1ccc2OCOc2c1
Show InChI InChI=1S/C22H21N5O2/c1-3-17-21(23-7-1)27-8-2-4-18(27)22(24-17)26-11-9-25(10-12-26)14-16-5-6-19-20(13-16)29-15-28-19/h1-8,13H,9-12,14-15H2
Affinity DataIC50: 0.794nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407784(CHEMBL51118)
Show SMILES C=CCN1CCN(CC1)c1nc2sccc2n2cccc12
Show InChI InChI=1S/C16H18N4S/c1-2-6-18-8-10-19(11-9-18)15-13-4-3-7-20(13)14-5-12-21-16(14)17-15/h2-5,7,12H,1,6,8-11H2
Affinity DataIC50: 0.912nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407784(CHEMBL51118)
Show SMILES C=CCN1CCN(CC1)c1nc2sccc2n2cccc12
Show InChI InChI=1S/C16H18N4S/c1-2-6-18-8-10-19(11-9-18)15-13-4-3-7-20(13)14-5-12-21-16(14)17-15/h2-5,7,12H,1,6,8-11H2
Affinity DataIC50: 0.912nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50081975(6-(4-Methyl-piperazin-1-yl)-pyrido[3,2-e]pyrrolo[1...)
Show SMILES CN1CCN(CC1)c1nc2cccnc2n2cccc12
Show InChI InChI=1S/C15H17N5/c1-18-8-10-19(11-9-18)15-13-5-3-7-20(13)14-12(17-15)4-2-6-16-14/h2-7H,8-11H2,1H3
Affinity DataIC50: 0.977nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407762(CHEMBL292725)
Show SMILES C(N1CCN(CC1)c1nc2sccc2n2cccc12)c1ccc2OCOc2c1
Show InChI InChI=1S/C21H20N4O2S/c1-2-16-20(22-21-17(5-11-28-21)25(16)6-1)24-9-7-23(8-10-24)13-15-3-4-18-19(12-15)27-14-26-18/h1-6,11-12H,7-10,13-14H2
Affinity DataIC50: 1nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407789(CHEMBL52772)
Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3sccc3n3cccc23)cc1
Show InChI InChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-17-2-1-8-25(17)18-7-13-26-20(18)22-19/h1-8,13H,9-12,14H2
Affinity DataIC50: 1.20nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407789(CHEMBL52772)
Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3sccc3n3cccc23)cc1
Show InChI InChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-17-2-1-8-25(17)18-7-13-26-20(18)22-19/h1-8,13H,9-12,14H2
Affinity DataIC50: 1.20nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407786(CHEMBL54720)
Show SMILES C(N1CCN(CC1)c1nc2ccsc2n2cccc12)c1ccccc1
Show InChI InChI=1S/C20H20N4S/c1-2-5-16(6-3-1)15-22-10-12-23(13-11-22)19-18-7-4-9-24(18)20-17(21-19)8-14-25-20/h1-9,14H,10-13,15H2
Affinity DataIC50: 1.40nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407786(CHEMBL54720)
Show SMILES C(N1CCN(CC1)c1nc2ccsc2n2cccc12)c1ccccc1
Show InChI InChI=1S/C20H20N4S/c1-2-5-16(6-3-1)15-22-10-12-23(13-11-22)19-18-7-4-9-24(18)20-17(21-19)8-14-25-20/h1-9,14H,10-13,15H2
Affinity DataIC50: 1.40nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408171(CHEMBL53490)
Show SMILES C1CN(CCN1)c1nc2cccnc2n2cccc12
Show InChI InChI=1S/C14H15N5/c1-3-11-13(16-5-1)19-8-2-4-12(19)14(17-11)18-9-6-15-7-10-18/h1-5,8,15H,6-7,9-10H2
Affinity DataIC50: 1.5nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408155(CHEMBL54125)
Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3ccccc3n3cccc23)cc1
Show InChI InChI=1S/C22H21FN4/c23-18-9-7-17(8-10-18)16-25-12-14-26(15-13-25)22-21-6-3-11-27(21)20-5-2-1-4-19(20)24-22/h1-11H,12-16H2
Affinity DataIC50: 2.40nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408164(CHEMBL52625)
Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3cccnc3n3cccc23)cc1
Show InChI InChI=1S/C21H20FN5/c22-17-7-5-16(6-8-17)15-25-11-13-26(14-12-25)21-19-4-2-10-27(19)20-18(24-21)3-1-9-23-20/h1-10H,11-15H2
Affinity DataIC50: 2.60nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407790(CHEMBL63790)
Show SMILES C(N1CCN(CC1)c1nc2ccsc2n2cccc12)c1ccc2OCOc2c1
Show InChI InChI=1S/C21H20N4O2S/c1-2-17-20(22-16-5-11-28-21(16)25(17)6-1)24-9-7-23(8-10-24)13-15-3-4-18-19(12-15)27-14-26-18/h1-6,11-12H,7-10,13-14H2
Affinity DataIC50: 2.60nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407785(CHEMBL62274)
Show SMILES C=CCN1CCN(CC1)c1nc2ccsc2n2cccc12
Show InChI InChI=1S/C16H18N4S/c1-2-6-18-8-10-19(11-9-18)15-14-4-3-7-20(14)16-13(17-15)5-12-21-16/h2-5,7,12H,1,6,8-11H2
Affinity DataIC50: 2.60nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407777(CHEMBL65710)
Show SMILES C(N1CCN(CC1)c1nc2sccc2n2cccc12)c1ccccc1
Show InChI InChI=1S/C20H20N4S/c1-2-5-16(6-3-1)15-22-10-12-23(13-11-22)19-17-7-4-9-24(17)18-8-14-25-20(18)21-19/h1-9,14H,10-13,15H2
Affinity DataIC50: 4.60nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408152(CHEMBL53662)
Show SMILES COc1ccc2c(c1)nc(N1CCN(Cc3ccc(F)cc3)CC1)c1cccn21
Show InChI InChI=1S/C23H23FN4O/c1-29-19-8-9-21-20(15-19)25-23(22-3-2-10-28(21)22)27-13-11-26(12-14-27)16-17-4-6-18(24)7-5-17/h2-10,15H,11-14,16H2,1H3
Affinity DataIC50: 6.60nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407769(CHEMBL301765)
Show SMILES C1CN(CCN1)c1nc2ccsc2n2cccc12
Show InChI InChI=1S/C13H14N4S/c1-2-11-12(16-7-4-14-5-8-16)15-10-3-9-18-13(10)17(11)6-1/h1-3,6,9,14H,4-5,7-8H2
Affinity DataIC50: 12nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407769(CHEMBL301765)
Show SMILES C1CN(CCN1)c1nc2ccsc2n2cccc12
Show InChI InChI=1S/C13H14N4S/c1-2-11-12(16-7-4-14-5-8-16)15-10-3-9-18-13(10)17(11)6-1/h1-3,6,9,14H,4-5,7-8H2
Affinity DataIC50: 12nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408159(CHEMBL300692)
Show SMILES Cc1ccc2c(c1)nc(N1CCN(Cc3ccc(F)cc3)CC1)c1cccn21
Show InChI InChI=1S/C23H23FN4/c1-17-4-9-21-20(15-17)25-23(22-3-2-10-28(21)22)27-13-11-26(12-14-27)16-18-5-7-19(24)8-6-18/h2-10,15H,11-14,16H2,1H3
Affinity DataIC50: 13nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 1B(Rattus norvegicus (Rat))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407769(CHEMBL301765)
Show SMILES C1CN(CCN1)c1nc2ccsc2n2cccc12
Show InChI InChI=1S/C13H14N4S/c1-2-11-12(16-7-4-14-5-8-16)15-10-3-9-18-13(10)17(11)6-1/h1-3,6,9,14H,4-5,7-8H2
Affinity DataIC50: 13.8nMAssay Description:Binding affinity for 5-hydroxytryptamine 1B receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 1B(Rattus norvegicus (Rat))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407769(CHEMBL301765)
Show SMILES C1CN(CCN1)c1nc2ccsc2n2cccc12
Show InChI InChI=1S/C13H14N4S/c1-2-11-12(16-7-4-14-5-8-16)15-10-3-9-18-13(10)17(11)6-1/h1-3,6,9,14H,4-5,7-8H2
Affinity DataIC50: 13.8nMAssay Description:Binding affinity towards 5-hydroxytryptamine 1B receptor was measured using [3H]5-HT as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408174(CHEMBL300725)
Show SMILES COc1ccc2nc(N3CCN(Cc4ccccc4)CC3)c3cccn3c2n1
Show InChI InChI=1S/C22H23N5O/c1-28-20-10-9-18-21(24-20)27-11-5-8-19(27)22(23-18)26-14-12-25(13-15-26)16-17-6-3-2-4-7-17/h2-11H,12-16H2,1H3
Affinity DataIC50: 14nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407752(CHEMBL294368)
Show SMILES Clc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)c(Cl)c1
Show InChI InChI=1S/C20H18Cl2N4S/c21-15-4-3-14(16(22)12-15)13-24-7-9-25(10-8-24)19-18-2-1-6-26(18)20-17(23-19)5-11-27-20/h1-6,11-12H,7-10,13H2
Affinity DataIC50: 17nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408170(CHEMBL299097)
Show SMILES C=CCN1CCN(CC1)c1nc2ccc3ncccc3c2n2cccc12
Show InChI InChI=1S/C21H21N5/c1-2-10-24-12-14-25(15-13-24)21-19-6-4-11-26(19)20-16-5-3-9-22-17(16)7-8-18(20)23-21/h2-9,11H,1,10,12-15H2
Affinity DataIC50: 20nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408175(CHEMBL410531)
Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3cc(Cl)ccc3n3cccc23)cc1
Show InChI InChI=1S/C22H20ClFN4/c23-17-5-8-20-19(14-17)25-22(21-2-1-9-28(20)21)27-12-10-26(11-13-27)15-16-3-6-18(24)7-4-16/h1-9,14H,10-13,15H2
Affinity DataIC50: 20nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408157(CHEMBL432897)
Show SMILES Clc1ccc2nc(N3CCN(Cc4ccccc4)CC3)c3cccn3c2c1
Show InChI InChI=1S/C22H21ClN4/c23-18-8-9-19-21(15-18)27-10-4-7-20(27)22(24-19)26-13-11-25(12-14-26)16-17-5-2-1-3-6-17/h1-10,15H,11-14,16H2
Affinity DataIC50: 20nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B(Rattus norvegicus)
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407772(CHEMBL418678)
Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3ccsc3n3cccc23)cc1
Show InChI InChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-18-2-1-8-25(18)20-17(22-19)7-13-26-20/h1-8,13H,9-12,14H2
Affinity DataIC50: 21nMAssay Description:Binding affinity towards 5-hydroxytryptamine 3 receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408163(CHEMBL52867)
Show SMILES C(N1CCN(CC1)c1nc2ccc3ncccc3c2n2cccc12)c1ccc2OCOc2c1
Show InChI InChI=1S/C26H23N5O2/c1-3-19-20(27-9-1)6-7-21-25(19)31-10-2-4-22(31)26(28-21)30-13-11-29(12-14-30)16-18-5-8-23-24(15-18)33-17-32-23/h1-10,15H,11-14,16-17H2
Affinity DataIC50: 28nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408154(CHEMBL50740)
Show SMILES C(N1CCN(CC1)c1nc2ccc3ncccc3c2n2cccc12)c1ccccc1
Show InChI InChI=1S/C25H23N5/c1-2-6-19(7-3-1)18-28-14-16-29(17-15-28)25-23-9-5-13-30(23)24-20-8-4-12-26-21(20)10-11-22(24)27-25/h1-13H,14-18H2
Affinity DataIC50: 31nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 2C(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407769(CHEMBL301765)
Show SMILES C1CN(CCN1)c1nc2ccsc2n2cccc12
Show InChI InChI=1S/C13H14N4S/c1-2-11-12(16-7-4-14-5-8-16)15-10-3-9-18-13(10)17(11)6-1/h1-3,6,9,14H,4-5,7-8H2
Affinity DataIC50: 34.7nMAssay Description:Binding affinity towards 5-hydroxytryptamine 2C receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 2C(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50407769(CHEMBL301765)
Show SMILES C1CN(CCN1)c1nc2ccsc2n2cccc12
Show InChI InChI=1S/C13H14N4S/c1-2-11-12(16-7-4-14-5-8-16)15-10-3-9-18-13(10)17(11)6-1/h1-3,6,9,14H,4-5,7-8H2
Affinity DataIC50: 34.7nMAssay Description:Binding affinity against 5-Hydroxytryptamine 2C Receptor was measured using [3H]N-methyl-mesulergine as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 3A/3B/3C/3D/3E(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM50408173(CHEMBL52612)
Show SMILES C(N1CCN(CC1)c1ncccc1-n1cccc1)c1ccccc1
Show InChI InChI=1S/C20H22N4/c1-2-7-18(8-3-1)17-22-13-15-24(16-14-22)20-19(9-6-10-21-20)23-11-4-5-12-23/h1-12H,13-17H2
Affinity DataIC50: 46nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor was measured using [3H]granisetron as radioligandMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 1A(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM81497(4-(4-Methyl-piperazin-1-yl)-7-trifluoromethyl-pyrr...)
Show SMILES CN1CCN(CC1)c1nc2cc(ccc2n2cccc12)C(F)(F)F
Show InChI InChI=1S/C17H17F3N4/c1-22-7-9-23(10-8-22)16-15-3-2-6-24(15)14-5-4-12(17(18,19)20)11-13(14)21-16/h2-6,11H,7-10H2,1H3
Affinity DataIC50: 46.8nMAssay Description:Binding affinity for 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 1A(Homo sapiens (Human))
Universit£ de Caen

Curated by ChEMBL
LigandPNGBDBM81497(4-(4-Methyl-piperazin-1-yl)-7-trifluoromethyl-pyrr...)
Show SMILES CN1CCN(CC1)c1nc2cc(ccc2n2cccc12)C(F)(F)F
Show InChI InChI=1S/C17H17F3N4/c1-22-7-9-23(10-8-22)16-15-3-2-6-24(15)14-5-4-12(17(18,19)20)11-13(14)21-16/h2-6,11H,7-10H2,1H3
Affinity DataIC50: 46.8nMAssay Description:Binding affinity against 5-hydroxytryptamine 1A receptor was measured using [3H]8-OH-DPAT as radioligandMore data for this Ligand-Target Pair
Displayed 1 to 50 (of 502 total ) | Next | Last >>
Jump to: