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Compile Data Set for Download or QSAR

Found 40 hits Enz. Inhib. hit(s) with all data for entry = 50018098   
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 2B


(Homo sapiens (Human))
BDBM50191171
PNG
(2-(4-flurophenyl)-1,10b-dihydro-benzo[e]pyrazolo[1...)
Show SMILES CCCN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccc(F)cc1 |c:20|
Show InChI InChI=1S/C23H26FN3O/c1-2-13-26-14-11-23(12-15-26)27-21(19-5-3-4-6-22(19)28-23)16-20(25-27)17-7-9-18(24)10-8-17/h3-10,21H,2,11-16H2,1H3
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n/an/a 1.80n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191182
PNG
(1-propyl-4'-(pyridin-4-yl)-8'-oxa-5',6'-diazaspiro...)
Show SMILES CCCN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccncc1 |c:20|
Show InChI InChI=1S/C22H26N4O/c1-2-13-25-14-9-22(10-15-25)26-20(18-5-3-4-6-21(18)27-22)16-19(24-26)17-7-11-23-12-8-17/h3-8,11-12,20H,2,9-10,13-16H2,1H3
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n/an/a 15n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191179
PNG
(1-(2-phenylethyl)-4'-(pyridin-4-yl)-8'-oxa-5',6'-d...)
Show SMILES C(Cc1ccccc1)N1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccncc1 |c:26|
Show InChI InChI=1S/C27H28N4O/c1-2-6-21(7-3-1)12-17-30-18-13-27(14-19-30)31-25(23-8-4-5-9-26(23)32-27)20-24(29-31)22-10-15-28-16-11-22/h1-11,15-16,25H,12-14,17-20H2
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n/an/a 16n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191173
PNG
(1-(2-methylpropyl)-4'-(pyridin-4-yl)-8'-oxa-5',6'-...)
Show SMILES CC(C)CN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccncc1 |c:21|
Show InChI InChI=1S/C23H28N4O/c1-17(2)16-26-13-9-23(10-14-26)27-21(19-5-3-4-6-22(19)28-23)15-20(25-27)18-7-11-24-12-8-18/h3-8,11-12,17,21H,9-10,13-16H2,1-2H3
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n/an/a 21n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191181
PNG
(12'-fluoro-4'-(4-fluorophenyl)-1-propyl-8'-oxa-5',...)
Show SMILES CCCN1CCC2(CC1)Oc1ccc(F)cc1C1CC(=NN21)c1ccc(F)cc1 |c:21|
Show InChI InChI=1S/C23H25F2N3O/c1-2-11-27-12-9-23(10-13-27)28-21(19-14-18(25)7-8-22(19)29-23)15-20(26-28)16-3-5-17(24)6-4-16/h3-8,14,21H,2,9-13,15H2,1H3
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n/an/a 26n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191208
PNG
(12'-bromo-4'-(4-fluorophenyl)-1-propyl-8'-oxa-5',6...)
Show SMILES CCCN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccc(F)cc1 |c:21|
Show InChI InChI=1S/C23H25BrFN3O/c1-2-11-27-12-9-23(10-13-27)28-21(19-14-17(24)5-8-22(19)29-23)15-20(26-28)16-3-6-18(25)7-4-16/h3-8,14,21H,2,9-13,15H2,1H3
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n/an/a 29n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191194
PNG
(12'-bromo-4'-(4-fluorophenyl)-1-methyl-8'-oxa-5',6...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccc(F)cc1 |c:19|
Show InChI InChI=1S/C21H21BrFN3O/c1-25-10-8-21(9-11-25)26-19(17-12-15(22)4-7-20(17)27-21)13-18(24-26)14-2-5-16(23)6-3-14/h2-7,12,19H,8-11,13H2,1H3
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n/an/a 30n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191191
PNG
(12'-chloro-4'-(4-fluorophenyl)-1-propyl-8'-oxa-5',...)
Show SMILES CCCN1CCC2(CC1)Oc1ccc(Cl)cc1C1CC(=NN21)c1ccc(F)cc1 |c:21|
Show InChI InChI=1S/C23H25ClFN3O/c1-2-11-27-12-9-23(10-13-27)28-21(19-14-17(24)5-8-22(19)29-23)15-20(26-28)16-3-6-18(25)7-4-16/h3-8,14,21H,2,9-13,15H2,1H3
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n/an/a 32n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191196
PNG
(1-ethyl-4'-(pyridin-4-yl)-8'-oxa-5',6'-diazaspiro[...)
Show SMILES CCN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccncc1 |c:19|
Show InChI InChI=1S/C21H24N4O/c1-2-24-13-9-21(10-14-24)25-19(17-5-3-4-6-20(17)26-21)15-18(23-25)16-7-11-22-12-8-16/h3-8,11-12,19H,2,9-10,13-15H2,1H3
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n/an/a 42n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191209
PNG
(4'-(4-fluorophenyl)-10'-methoxy-1-methyl-8'-oxa-5'...)
Show SMILES COc1cccc2C3CC(=NN3C3(CCN(C)CC3)Oc12)c1ccc(F)cc1 |c:9|
Show InChI InChI=1S/C22H24FN3O2/c1-25-12-10-22(11-13-25)26-19(17-4-3-5-20(27-2)21(17)28-22)14-18(24-26)15-6-8-16(23)9-7-15/h3-9,19H,10-14H2,1-2H3
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n/an/a 46n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191188
PNG
(1-methyl-4'-phenyl-8'-oxa-5',6'-diazaspiro[piperid...)
Show SMILES CN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccccc1 |c:18|
Show InChI InChI=1S/C21H23N3O/c1-23-13-11-21(12-14-23)24-19(17-9-5-6-10-20(17)25-21)15-18(22-24)16-7-3-2-4-8-16/h2-10,19H,11-15H2,1H3
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n/an/a 50n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191178
PNG
(12'-bromo-1-methyl-4'-phenyl-8'-oxa-5',6'-diazaspi...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccccc1 |c:19|
Show InChI InChI=1S/C21H22BrN3O/c1-24-11-9-21(10-12-24)25-19(17-13-16(22)7-8-20(17)26-21)14-18(23-25)15-5-3-2-4-6-15/h2-8,13,19H,9-12,14H2,1H3
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n/an/a 92n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191212
PNG
(1-methyl-4'-(pyridin-4-yl)-8'-oxa-5',6'-diazaspiro...)
Show SMILES CN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccncc1 |c:18|
Show InChI InChI=1S/C20H22N4O/c1-23-12-8-20(9-13-23)24-18(16-4-2-3-5-19(16)25-20)14-17(22-24)15-6-10-21-11-7-15/h2-7,10-11,18H,8-9,12-14H2,1H3
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n/an/a 95n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191187
PNG
(12'-bromo-4'-(4-chlorophenyl)-1-methyl-8'-oxa-5',6...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccc(Cl)cc1 |c:19|
Show InChI InChI=1S/C21H21BrClN3O/c1-25-10-8-21(9-11-25)26-19(17-12-15(22)4-7-20(17)27-21)13-18(24-26)14-2-5-16(23)6-3-14/h2-7,12,19H,8-11,13H2,1H3
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n/an/a 100n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191180
PNG
(4'-(4-fluorophenyl)-12'-methyl-1-propyl-8'-oxa-5',...)
Show SMILES CCCN1CCC2(CC1)Oc1ccc(C)cc1C1CC(=NN21)c1ccc(F)cc1 |c:21|
Show InChI InChI=1S/C24H28FN3O/c1-3-12-27-13-10-24(11-14-27)28-22(20-15-17(2)4-9-23(20)29-24)16-21(26-28)18-5-7-19(25)8-6-18/h4-9,15,22H,3,10-14,16H2,1-2H3
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n/an/a 115n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191175
PNG
(4'-(4-chlorophenyl)-1-(propan-2-yl)-8'-oxa-5',6'-d...)
Show SMILES CC(C)N1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccc(Cl)cc1 |c:20|
Show InChI InChI=1S/C23H26ClN3O/c1-16(2)26-13-11-23(12-14-26)27-21(19-5-3-4-6-22(19)28-23)15-20(25-27)17-7-9-18(24)10-8-17/h3-10,16,21H,11-15H2,1-2H3
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n/an/a 133n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191211
PNG
(12'-bromo-4'-[4-(difluoromethoxy)phenyl]-1-methyl-...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccc(OC(F)F)cc1 |c:19|
Show InChI InChI=1S/C22H22BrF2N3O2/c1-27-10-8-22(9-11-27)28-19(17-12-15(23)4-7-20(17)30-22)13-18(26-28)14-2-5-16(6-3-14)29-21(24)25/h2-7,12,19,21H,8-11,13H2,1H3
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n/an/a 175n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191172
PNG
(12'-bromo-4'-(4-methoxyphenyl)-1-propyl-8'-oxa-5',...)
Show SMILES CCCN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccc(OC)cc1 |c:21|
Show InChI InChI=1S/C24H28BrN3O2/c1-3-12-27-13-10-24(11-14-27)28-22(20-15-18(25)6-9-23(20)30-24)16-21(26-28)17-4-7-19(29-2)8-5-17/h4-9,15,22H,3,10-14,16H2,1-2H3
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n/an/a 179n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191185
PNG
(12'-bromo-4'-phenyl-1-(propan-2-yl)-8'-oxa-5',6'-d...)
Show SMILES CC(C)N1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccccc1 |c:21|
Show InChI InChI=1S/C23H26BrN3O/c1-16(2)26-12-10-23(11-13-26)27-21(19-14-18(24)8-9-22(19)28-23)15-20(25-27)17-6-4-3-5-7-17/h3-9,14,16,21H,10-13,15H2,1-2H3
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n/an/a 188n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191204
PNG
(4'-(4-chlorophenyl)-1-methyl-8'-oxa-5',6'-diazaspi...)
Show SMILES CN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccc(Cl)cc1 |c:18|
Show InChI InChI=1S/C21H22ClN3O/c1-24-12-10-21(11-13-24)25-19(17-4-2-3-5-20(17)26-21)14-18(23-25)15-6-8-16(22)9-7-15/h2-9,19H,10-14H2,1H3
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n/an/a 280n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191206
PNG
(1-benzyl-4'-(4-chlorophenyl)-8'-oxa-5',6'-diazaspi...)
Show SMILES Clc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC21CCN(Cc2ccccc2)CC1 |t:8|
Show InChI InChI=1S/C27H26ClN3O/c28-22-12-10-21(11-13-22)24-18-25-23-8-4-5-9-26(23)32-27(31(25)29-24)14-16-30(17-15-27)19-20-6-2-1-3-7-20/h1-13,25H,14-19H2
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n/an/a 350n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191210
PNG
(4'-(4-bromophenyl)-1-methyl-8'-oxa-5',6'-diazaspir...)
Show SMILES CN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccc(Br)cc1 |c:18|
Show InChI InChI=1S/C21H22BrN3O/c1-24-12-10-21(11-13-24)25-19(17-4-2-3-5-20(17)26-21)14-18(23-25)15-6-8-16(22)9-7-15/h2-9,19H,10-14H2,1H3
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n/an/a 426n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191199
PNG
(12'-bromo-4'-[2-(difluoromethoxy)phenyl]-1-methyl-...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccccc1OC(F)F |c:19|
Show InChI InChI=1S/C22H22BrF2N3O2/c1-27-10-8-22(9-11-27)28-18(16-12-14(23)6-7-20(16)30-22)13-17(26-28)15-4-2-3-5-19(15)29-21(24)25/h2-7,12,18,21H,8-11,13H2,1H3
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n/an/a 427n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191176
PNG
(4'-(2-chlorophenyl)-1-propyl-8'-oxa-5',6'-diazaspi...)
Show SMILES CCCN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccccc1Cl |c:20|
Show InChI InChI=1S/C23H26ClN3O/c1-2-13-26-14-11-23(12-15-26)27-21(18-8-4-6-10-22(18)28-23)16-20(25-27)17-7-3-5-9-19(17)24/h3-10,21H,2,11-16H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191192
PNG
(12'-bromo-4'-(3,4-dichlorophenyl)-1-methyl-8'-oxa-...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccc(Cl)c(Cl)c1 |c:19|
Show InChI InChI=1S/C21H20BrCl2N3O/c1-26-8-6-21(7-9-26)27-19(15-11-14(22)3-5-20(15)28-21)12-18(25-27)13-2-4-16(23)17(24)10-13/h2-5,10-11,19H,6-9,12H2,1H3
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n/an/a 542n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191186
PNG
(4'-(2-chlorophenyl)-1-methyl-8'-oxa-5',6'-diazaspi...)
Show SMILES CN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccccc1Cl |c:18|
Show InChI InChI=1S/C21H22ClN3O/c1-24-12-10-21(11-13-24)25-19(16-7-3-5-9-20(16)26-21)14-18(23-25)15-6-2-4-8-17(15)22/h2-9,19H,10-14H2,1H3
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n/an/a 753n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191195
PNG
(12'-bromo-4'-(4-bromophenyl)-1-propyl-8'-oxa-5',6'...)
Show SMILES CCCN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccc(Br)cc1 |c:21|
Show InChI InChI=1S/C23H25Br2N3O/c1-2-11-27-12-9-23(10-13-27)28-21(19-14-18(25)7-8-22(19)29-23)15-20(26-28)16-3-5-17(24)6-4-16/h3-8,14,21H,2,9-13,15H2,1H3
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n/an/a 791n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191207
PNG
(12'-bromo-4'-(2-chlorophenyl)-1-methyl-8'-oxa-5',6...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccccc1Cl |c:19|
Show InChI InChI=1S/C21H21BrClN3O/c1-25-10-8-21(9-11-25)26-19(16-12-14(22)6-7-20(16)27-21)13-18(24-26)15-4-2-3-5-17(15)23/h2-7,12,19H,8-11,13H2,1H3
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n/an/a 856n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191203
PNG
(4'-(4-bromophenyl)-10'-methoxy-1-methyl-8'-oxa-5',...)
Show SMILES COc1cccc2C3CC(=NN3C3(CCN(C)CC3)Oc12)c1ccc(Br)cc1 |c:9|
Show InChI InChI=1S/C22H24BrN3O2/c1-25-12-10-22(11-13-25)26-19(17-4-3-5-20(27-2)21(17)28-22)14-18(24-26)15-6-8-16(23)9-7-15/h3-9,19H,10-14H2,1-2H3
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n/an/a 1.28E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191193
PNG
(4'-(4-chlorophenyl)-10'-methoxy-1-methyl-8'-oxa-5'...)
Show SMILES COc1cccc2C3CC(=NN3C3(CCN(C)CC3)Oc12)c1ccc(Cl)cc1 |c:9|
Show InChI InChI=1S/C22H24ClN3O2/c1-25-12-10-22(11-13-25)26-19(17-4-3-5-20(27-2)21(17)28-22)14-18(24-26)15-6-8-16(23)9-7-15/h3-9,19H,10-14H2,1-2H3
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n/an/a 1.47E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191174
PNG
(12'-bromo-4'-(4-methylphenyl)-1-propyl-8'-oxa-5',6...)
Show SMILES CCCN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccc(C)cc1 |c:21|
Show InChI InChI=1S/C24H28BrN3O/c1-3-12-27-13-10-24(11-14-27)28-22(20-15-19(25)8-9-23(20)29-24)16-21(26-28)18-6-4-17(2)5-7-18/h4-9,15,22H,3,10-14,16H2,1-2H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191205
PNG
(12'-bromo-4'-(furan-2-yl)-1-methyl-8'-oxa-5',6'-di...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccco1 |c:19|
Show InChI InChI=1S/C19H20BrN3O2/c1-22-8-6-19(7-9-22)23-16(12-15(21-23)18-3-2-10-24-18)14-11-13(20)4-5-17(14)25-19/h2-5,10-11,16H,6-9,12H2,1H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191202
PNG
(12'-bromo-4'-(3,4-dimethoxyphenyl)-1-methyl-8'-oxa...)
Show SMILES COc1ccc(cc1OC)C1=NN2C(C1)c1cc(Br)ccc1OC21CCN(C)CC1 |t:11|
Show InChI InChI=1S/C23H26BrN3O3/c1-26-10-8-23(9-11-26)27-19(17-13-16(24)5-7-20(17)30-23)14-18(25-27)15-4-6-21(28-2)22(12-15)29-3/h4-7,12-13,19H,8-11,14H2,1-3H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191177
PNG
(12'-bromo-4'-(4-methoxyphenyl)-1-methyl-8'-oxa-5',...)
Show SMILES COc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC21CCN(C)CC1 |t:9|
Show InChI InChI=1S/C22H24BrN3O2/c1-25-11-9-22(10-12-25)26-20(18-13-16(23)5-8-21(18)28-22)14-19(24-26)15-3-6-17(27-2)7-4-15/h3-8,13,20H,9-12,14H2,1-2H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191198
PNG
(12'-bromo-1-methyl-4'-(naphthalen-2-yl)-8'-oxa-5',...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1ccc2ccccc2c1 |c:19|
Show InChI InChI=1S/C25H24BrN3O/c1-28-12-10-25(11-13-28)29-23(21-15-20(26)8-9-24(21)30-25)16-22(27-29)19-7-6-17-4-2-3-5-18(17)14-19/h2-9,14-15,23H,10-13,16H2,1H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191183
PNG
(12'-bromo-1-methyl-4'-(thiophen-2-yl)-8'-oxa-5',6'...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1cccs1 |c:19|
Show InChI InChI=1S/C19H20BrN3OS/c1-22-8-6-19(7-9-22)23-16(12-15(21-23)18-3-2-10-25-18)14-11-13(20)4-5-17(14)24-19/h2-5,10-11,16H,6-9,12H2,1H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191190
PNG
(12'-bromo-4'-(2-methoxyphenyl)-1-methyl-8'-oxa-5',...)
Show SMILES COc1ccccc1C1=NN2C(C1)c1cc(Br)ccc1OC21CCN(C)CC1 |t:9|
Show InChI InChI=1S/C22H24BrN3O2/c1-25-11-9-22(10-12-25)26-19(17-13-15(23)7-8-21(17)28-22)14-18(24-26)16-5-3-4-6-20(16)27-2/h3-8,13,19H,9-12,14H2,1-2H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191184
PNG
(4,4-dimethyl-2-pyridin-4-yl-1,9b-dihydro-5-oxa-3,3...)
Show SMILES CC1(C)Oc2ccccc2C2CC(=NN12)c1ccncc1 |c:13|
Show InChI InChI=1S/C17H17N3O/c1-17(2)20-15(13-5-3-4-6-16(13)21-17)11-14(19-20)12-7-9-18-10-8-12/h3-10,15H,11H2,1-2H3
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Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191189
PNG
(4'-(4-bromophenyl)-1-(propan-2-yl)-8'-oxa-5',6'-di...)
Show SMILES CC(C)N1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccc(Br)cc1 |c:20|
Show InChI InChI=1S/C23H26BrN3O/c1-16(2)26-13-11-23(12-14-26)27-21(19-5-3-4-6-22(19)28-23)15-20(25-27)17-7-9-18(24)10-8-17/h3-10,16,21H,11-15H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50191200
PNG
(12'-bromo-1-methyl-4'-(naphthalen-1-yl)-8'-oxa-5',...)
Show SMILES CN1CCC2(CC1)Oc1ccc(Br)cc1C1CC(=NN21)c1cccc2ccccc12 |c:19|
Show InChI InChI=1S/C25H24BrN3O/c1-28-13-11-25(12-14-28)29-23(21-15-18(26)9-10-24(21)30-25)16-22(27-29)20-8-4-6-17-5-2-3-7-19(17)20/h2-10,15,23H,11-14,16H2,1H3
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Hopital Saint-Louis

Curated by ChEMBL


Assay Description
Activity at 5HT2B receptor expressed in CHO cell assessed as inhibition of alpha-methyl-5HT-stimulated calcium release


Bioorg Med Chem Lett 16: 4830-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.068
BindingDB Entry DOI: 10.7270/Q2BV7G7X
More data for this
Ligand-Target Pair