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PubMed code 21871797

Compile data set for download or QSAR
Found 33 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
OPIATE Sigma


(RAT)
BDBM50354654
PNG
(CHEMBL1833977)
Show SMILES COc1ccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1
Show InChI InChI=1S/C23H28N2O2/c1-26-21-10-8-19(9-11-21)5-4-12-24-13-15-25(16-14-24)18-22-17-20-6-2-3-7-23(20)27-22/h2-3,6-11,17H,4-5,12-16,18H2,1H3
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3.10n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354662
PNG
(CHEMBL1834258)
Show SMILES C(CCc1ccccc1)CN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C23H28N2O/c1-2-8-20(9-3-1)10-6-7-13-24-14-16-25(17-15-24)19-22-18-21-11-4-5-12-23(21)26-22/h1-5,8-9,11-12,18H,6-7,10,13-17,19H2
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4.20n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354659
PNG
(CHEMBL1834255)
Show SMILES C(CN1CCN(Cc2cc3ccccc3o2)CC1)Cc1ccccc1
Show InChI InChI=1S/C22H26N2O/c1-2-7-19(8-3-1)9-6-12-23-13-15-24(16-14-23)18-21-17-20-10-4-5-11-22(20)25-21/h1-5,7-8,10-11,17H,6,9,12-16,18H2
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5.70n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354661
PNG
(CHEMBL1834257)
Show SMILES COc1cccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)c1
Show InChI InChI=1S/C23H28N2O2/c1-26-21-9-4-6-19(16-21)7-5-11-24-12-14-25(15-13-24)18-22-17-20-8-2-3-10-23(20)27-22/h2-4,6,8-10,16-17H,5,7,11-15,18H2,1H3
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5.70n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354655
PNG
(CHEMBL1834251)
Show SMILES C(Cc1ccccc1)N1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C21H24N2O/c1-2-6-18(7-3-1)10-11-22-12-14-23(15-13-22)17-20-16-19-8-4-5-9-21(19)24-20/h1-9,16H,10-15,17H2
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7.30n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354664
PNG
(CHEMBL1834260)
Show SMILES COc1cccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)c1
Show InChI InChI=1S/C24H30N2O2/c1-27-22-10-6-8-20(17-22)7-4-5-12-25-13-15-26(16-14-25)19-23-18-21-9-2-3-11-24(21)28-23/h2-3,6,8-11,17-18H,4-5,7,12-16,19H2,1H3
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7.60n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354660
PNG
(CHEMBL1834256)
Show SMILES COc1ccccc1CCCN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C23H28N2O2/c1-26-22-10-4-2-7-19(22)9-6-12-24-13-15-25(16-14-24)18-21-17-20-8-3-5-11-23(20)27-21/h2-5,7-8,10-11,17H,6,9,12-16,18H2,1H3
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8.30n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354658
PNG
(CHEMBL1834254)
Show SMILES COc1ccc(CCN2CCN(Cc3cc4ccccc4o3)CC2)cc1
Show InChI InChI=1S/C22H26N2O2/c1-25-20-8-6-18(7-9-20)10-11-23-12-14-24(15-13-23)17-21-16-19-4-2-3-5-22(19)26-21/h2-9,16H,10-15,17H2,1H3
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9.40n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354657
PNG
(CHEMBL1834253)
Show SMILES COc1cccc(CCN2CCN(Cc3cc4ccccc4o3)CC2)c1
Show InChI InChI=1S/C22H26N2O2/c1-25-20-7-4-5-18(15-20)9-10-23-11-13-24(14-12-23)17-21-16-19-6-2-3-8-22(19)26-21/h2-8,15-16H,9-14,17H2,1H3
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13n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354665
PNG
(CHEMBL1834261)
Show SMILES COc1ccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1
Show InChI InChI=1S/C24H30N2O2/c1-27-22-11-9-20(10-12-22)6-4-5-13-25-14-16-26(17-15-25)19-23-18-21-7-2-3-8-24(21)28-23/h2-3,7-12,18H,4-6,13-17,19H2,1H3
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13n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354663
PNG
(CHEMBL1834259)
Show SMILES COc1ccccc1CCCCN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C24H30N2O2/c1-27-23-11-4-2-8-20(23)9-6-7-13-25-14-16-26(17-15-25)19-22-18-21-10-3-5-12-24(21)28-22/h2-5,8,10-12,18H,6-7,9,13-17,19H2,1H3
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16n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
OPIATE Sigma


(RAT)
BDBM50354656
PNG
(CHEMBL1834252)
Show SMILES COc1ccccc1CCN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C22H26N2O2/c1-25-21-8-4-2-6-18(21)10-11-23-12-14-24(15-13-23)17-20-16-19-7-3-5-9-22(19)26-20/h2-9,16H,10-15,17H2,1H3
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17n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenate after 2.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50354662
PNG
(CHEMBL1834258)
Show SMILES C(CCc1ccccc1)CN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C23H28N2O/c1-2-8-20(9-3-1)10-6-7-13-24-14-16-25(17-15-24)19-22-18-21-11-4-5-12-23(21)26-22/h1-5,8-9,11-12,18H,6-7,10,13-17,19H2
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89n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354656
PNG
(CHEMBL1834252)
Show SMILES COc1ccccc1CCN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C22H26N2O2/c1-25-21-8-4-2-6-18(21)10-11-23-12-14-24(15-13-23)17-20-16-19-7-3-5-9-22(19)26-20/h2-9,16H,10-15,17H2,1H3
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120n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354659
PNG
(CHEMBL1834255)
Show SMILES C(CN1CCN(Cc2cc3ccccc3o2)CC1)Cc1ccccc1
Show InChI InChI=1S/C22H26N2O/c1-2-7-19(8-3-1)9-6-12-23-13-15-24(16-14-23)18-21-17-20-10-4-5-11-22(20)25-21/h1-5,7-8,10-11,17H,6,9,12-16,18H2
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147n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354654
PNG
(CHEMBL1833977)
Show SMILES COc1ccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1
Show InChI InChI=1S/C23H28N2O2/c1-26-21-10-8-19(9-11-21)5-4-12-24-13-15-25(16-14-24)18-22-17-20-6-2-3-7-23(20)27-22/h2-3,6-11,17H,4-5,12-16,18H2,1H3
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155n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354661
PNG
(CHEMBL1834257)
Show SMILES COc1cccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)c1
Show InChI InChI=1S/C23H28N2O2/c1-26-21-9-4-6-19(16-21)7-5-11-24-12-14-25(15-13-24)18-22-17-20-8-2-3-10-23(20)27-22/h2-4,6,8-10,16-17H,5,7,11-15,18H2,1H3
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243n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354662
PNG
(CHEMBL1834258)
Show SMILES C(CCc1ccccc1)CN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C23H28N2O/c1-2-8-20(9-3-1)10-6-7-13-24-14-16-25(17-15-24)19-22-18-21-11-4-5-12-23(21)26-22/h1-5,8-9,11-12,18H,6-7,10,13-17,19H2
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275n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354657
PNG
(CHEMBL1834253)
Show SMILES COc1cccc(CCN2CCN(Cc3cc4ccccc4o3)CC2)c1
Show InChI InChI=1S/C22H26N2O2/c1-25-20-7-4-5-18(15-20)9-10-23-11-13-24(14-12-23)17-21-16-19-6-2-3-8-22(19)26-21/h2-8,15-16H,9-14,17H2,1H3
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290n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354655
PNG
(CHEMBL1834251)
Show SMILES C(Cc1ccccc1)N1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C21H24N2O/c1-2-6-18(7-3-1)10-11-22-12-14-23(15-13-22)17-20-16-19-8-4-5-9-21(19)24-20/h1-9,16H,10-15,17H2
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310n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354663
PNG
(CHEMBL1834259)
Show SMILES COc1ccccc1CCCCN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C24H30N2O2/c1-27-23-11-4-2-8-20(23)9-6-7-13-25-14-16-26(17-15-25)19-22-18-21-10-3-5-12-24(21)28-22/h2-5,8,10-12,18H,6-7,9,13-17,19H2,1H3
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332n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354664
PNG
(CHEMBL1834260)
Show SMILES COc1cccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)c1
Show InChI InChI=1S/C24H30N2O2/c1-27-22-10-6-8-20(17-22)7-4-5-12-25-13-15-26(16-14-25)19-23-18-21-9-2-3-11-24(21)28-23/h2-3,6,8-11,17-18H,4-5,7,12-16,19H2,1H3
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343n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354665
PNG
(CHEMBL1834261)
Show SMILES COc1ccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1
Show InChI InChI=1S/C24H30N2O2/c1-27-22-11-9-20(10-12-22)6-4-5-13-25-14-16-26(17-15-25)19-23-18-21-7-2-3-8-24(21)28-23/h2-3,7-12,18H,4-6,13-17,19H2,1H3
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352n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50354663
PNG
(CHEMBL1834259)
Show SMILES COc1ccccc1CCCCN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C24H30N2O2/c1-27-23-11-4-2-8-20(23)9-6-7-13-25-14-16-26(17-15-25)19-22-18-21-10-3-5-12-24(21)28-22/h2-5,8,10-12,18H,6-7,9,13-17,19H2,1H3
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432n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354658
PNG
(CHEMBL1834254)
Show SMILES COc1ccc(CCN2CCN(Cc3cc4ccccc4o3)CC2)cc1
Show InChI InChI=1S/C22H26N2O2/c1-25-20-8-6-18(7-9-20)10-11-23-12-14-24(15-13-23)17-21-16-19-4-2-3-5-22(19)26-21/h2-9,16H,10-15,17H2,1H3
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463n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50354664
PNG
(CHEMBL1834260)
Show SMILES COc1cccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)c1
Show InChI InChI=1S/C24H30N2O2/c1-27-22-10-6-8-20(17-22)7-4-5-12-25-13-15-26(16-14-25)19-23-18-21-9-2-3-11-24(21)28-23/h2-3,6,8-11,17-18H,4-5,7,12-16,19H2,1H3
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484n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50354661
PNG
(CHEMBL1834257)
Show SMILES COc1cccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)c1
Show InChI InChI=1S/C23H28N2O2/c1-26-21-9-4-6-19(16-21)7-5-11-24-12-14-25(15-13-24)18-22-17-20-8-2-3-10-23(20)27-22/h2-4,6,8-10,16-17H,5,7,11-15,18H2,1H3
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556n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50354660
PNG
(CHEMBL1834256)
Show SMILES COc1ccccc1CCCN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C23H28N2O2/c1-26-22-10-4-2-7-19(22)9-6-12-24-13-15-25(16-14-24)18-21-17-20-8-3-5-11-23(20)27-21/h2-5,7-8,10-11,17H,6,9,12-16,18H2,1H3
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628n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50354659
PNG
(CHEMBL1834255)
Show SMILES C(CN1CCN(Cc2cc3ccccc3o2)CC1)Cc1ccccc1
Show InChI InChI=1S/C22H26N2O/c1-2-7-19(8-3-1)9-6-12-23-13-15-24(16-14-23)18-21-17-20-10-4-5-11-22(20)25-21/h1-5,7-8,10-11,17H,6,9,12-16,18H2
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1.03E+3n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50354656
PNG
(CHEMBL1834252)
Show SMILES COc1ccccc1CCN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C22H26N2O2/c1-25-21-8-4-2-6-18(21)10-11-23-12-14-24(15-13-23)17-20-16-19-7-3-5-9-22(19)26-20/h2-9,16H,10-15,17H2,1H3
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1.65E+3n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50354665
PNG
(CHEMBL1834261)
Show SMILES COc1ccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1
Show InChI InChI=1S/C24H30N2O2/c1-27-22-11-9-20(10-12-22)6-4-5-13-25-14-16-26(17-15-25)19-23-18-21-7-2-3-8-24(21)28-23/h2-3,7-12,18H,4-6,13-17,19H2,1H3
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5.79E+3n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50354660
PNG
(CHEMBL1834256)
Show SMILES COc1ccccc1CCCN1CCN(Cc2cc3ccccc3o2)CC1
Show InChI InChI=1S/C23H28N2O2/c1-26-22-10-4-2-7-19(22)9-6-12-24-13-15-25(16-14-24)18-21-17-20-8-3-5-11-23(20)27-21/h2-5,7-8,10-11,17H,6,9,12-16,18H2,1H3
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5.87E+3n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50354654
PNG
(CHEMBL1833977)
Show SMILES COc1ccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1
Show InChI InChI=1S/C23H28N2O2/c1-26-21-10-8-19(9-11-21)5-4-12-24-13-15-25(16-14-24)18-22-17-20-6-2-3-7-23(20)27-22/h2-3,6-11,17H,4-5,12-16,18H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting


Bioorg Med Chem Lett 21: 5707-10 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.029
BindingDB Entry DOI: 10.7270/Q20Z73P4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%