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PubMed code 7783131

Compile data set for download or QSAR
Found 78 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
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035097
PNG
(1''-benzyl-3,4-dihydro-2H-spiro[naphthalene-1,4''-...)
Show SMILES C(N1CCC2(CCCc3ccccc23)CC1)c1ccccc1
Show InChI InChI=1S/C21H25N/c1-2-7-18(8-3-1)17-22-15-13-21(14-16-22)12-6-10-19-9-4-5-11-20(19)21/h1-5,7-9,11H,6,10,12-17H2
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n/an/a 0.260n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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n/an/a 0.650n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035114
PNG
(1'-[4-(1-methylsulfonyl-1H-3-indolyl)butyl]spiro[1...)
Show SMILES CS(=O)(=O)n1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C25H30N2O3S/c1-31(28,29)27-18-20(22-10-3-5-12-24(22)27)8-6-7-15-26-16-13-25(14-17-26)23-11-4-2-9-21(23)19-30-25/h2-5,9-12,18H,6-8,13-17,19H2,1H3
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n/an/a 1.30n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035108
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperidin-1-yl]-butyl}-1...)
Show SMILES Fc1ccc(cc1)C1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C23H27FN2/c24-21-10-8-18(9-11-21)19-12-15-26(16-13-19)14-4-3-5-20-17-25-23-7-2-1-6-22(20)23/h1-2,6-11,17,19,25H,3-5,12-16H2
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n/an/a 1.40n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50002164
PNG
(3-[4-(4-Phenyl-piperidin-1-yl)-butyl]-1H-indole | ...)
Show SMILES C(CCc1c[nH]c2ccccc12)CN1CCC(CC1)c1ccccc1
Show InChI InChI=1S/C23H28N2/c1-2-8-19(9-3-1)20-13-16-25(17-14-20)15-7-6-10-21-18-24-23-12-5-4-11-22(21)23/h1-5,8-9,11-12,18,20,24H,6-7,10,13-17H2
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n/an/a 1.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035095
PNG
(1'-[4-(1-methyl-1H-3-indolyl)butyl]spiro[1,3-dihyd...)
Show SMILES Cn1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C25H30N2O/c1-26-18-20(22-10-3-5-12-24(22)26)8-6-7-15-27-16-13-25(14-17-27)23-11-4-2-9-21(23)19-28-25/h2-5,9-12,18H,6-8,13-17,19H2,1H3
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n/an/a 2.10n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035101
PNG
(1'-[4-(1H-3-indolyl)butyl]spiro[1,3-dihydroisobenz...)
Show SMILES C(CCc1c[nH]c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Show InChI InChI=1S/C24H28N2O/c1-3-10-22-20(8-1)18-27-24(22)12-15-26(16-13-24)14-6-5-7-19-17-25-23-11-4-2-9-21(19)23/h1-4,8-11,17,25H,5-7,12-16,18H2
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n/an/a 2.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50002218
PNG
(2-(1-Cyclopropylmethyl-piperidin-4-yl)-1-(4-fluoro...)
Show SMILES Fc1ccc(cc1)C(=O)CC1CCN(CC2CC2)CC1
Show InChI InChI=1S/C17H22FNO/c18-16-5-3-15(4-6-16)17(20)11-13-7-9-19(10-8-13)12-14-1-2-14/h3-6,13-14H,1-2,7-12H2
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n/an/a 2.60n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035100
PNG
(1'-[1-(4-fluorophenyl)-1H-3-indolylmethyl]spiro[1,...)
Show SMILES Fc1ccc(cc1)-n1cc(CN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C27H25FN2O/c28-22-9-11-23(12-10-22)30-18-21(24-6-2-4-8-26(24)30)17-29-15-13-27(14-16-29)25-7-3-1-5-20(25)19-31-27/h1-12,18H,13-17,19H2
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n/an/a 3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035131
PNG
((+)-(6R,11S)-6,11-dimethyl-3-(3-methyl-but-2-enyl)...)
Show SMILES [#6]-[#6@@H]1-[#6@@H]-2-[#6]-c3ccc(-[#8])cc3[C@@]1([#6])[#6]-[#6]-[#7]-2-[#6]\[#6]=[#6](/[#6])-[#6] |r,TLB:16:15:10.4.3:1|
Show InChI InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14-,18+,19+/m1/s1
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035096
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperidin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1C1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C24H30N2O/c1-27-24-12-5-3-10-22(24)19-13-16-26(17-14-19)15-7-6-8-20-18-25-23-11-4-2-9-21(20)23/h2-5,9-12,18-19,25H,6-8,13-17H2,1H3
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n/an/a 4.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035119
PNG
(1'-[4-(1-benzyl-1H-3-indolyl)butyl]spiro[1,3-dihyd...)
Show SMILES C(CCc1cn(Cc2ccccc2)c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Show InChI InChI=1S/C31H34N2O/c1-2-10-25(11-3-1)22-33-23-26(28-14-5-7-16-30(28)33)12-8-9-19-32-20-17-31(18-21-32)29-15-6-4-13-27(29)24-34-31/h1-7,10-11,13-16,23H,8-9,12,17-22,24H2
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n/an/a 5.20n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035099
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-butyl}-1...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C22H26FN3/c23-19-8-10-20(11-9-19)26-15-13-25(14-16-26)12-4-3-5-18-17-24-22-7-2-1-6-21(18)22/h1-2,6-11,17,24H,3-5,12-16H2
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n/an/a 5.60n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035110
PNG
(1-{3-[4-spiro[1,3-dihydroisobenzofuran-1,4'-(hexah...)
Show SMILES CC(=O)n1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C26H30N2O2/c1-20(29)28-18-21(23-10-3-5-12-25(23)28)8-6-7-15-27-16-13-26(14-17-27)24-11-4-2-9-22(24)19-30-26/h2-5,9-12,18H,6-8,13-17,19H2,1H3
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n/an/a 5.70n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035118
PNG
(1'-{4-[1-(3-thienyl)-1H-3-indolyl]butyl}spiro[1,3-...)
Show SMILES C(CCc1cn(-c2ccsc2)c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Show InChI InChI=1S/C28H30N2OS/c1-3-10-26-23(8-1)20-31-28(26)13-16-29(17-14-28)15-6-5-7-22-19-30(24-12-18-32-21-24)27-11-4-2-9-25(22)27/h1-4,8-12,18-19,21H,5-7,13-17,20H2
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n/an/a 7n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50002171
PNG
(3-{4-[4-(4-Fluoro-phenyl)-3,6-dihydro-2H-pyridin-1...)
Show SMILES Fc1ccc(cc1)C1=CCN(CCCCc2c[nH]c3ccccc23)CC1 |t:8|
Show InChI InChI=1S/C23H25FN2/c24-21-10-8-18(9-11-21)19-12-15-26(16-13-19)14-4-3-5-20-17-25-23-7-2-1-6-22(20)23/h1-2,6-12,17,25H,3-5,13-16H2
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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n/an/a 7.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035111
PNG
(1'-{4-[1-(2-thienyl)-1H-3-indolyl]butyl}spiro[1,3-...)
Show SMILES C(CCc1cn(-c2cccs2)c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Show InChI InChI=1S/C28H30N2OS/c1-3-11-25-23(9-1)21-31-28(25)14-17-29(18-15-28)16-6-5-8-22-20-30(27-13-7-19-32-27)26-12-4-2-10-24(22)26/h1-4,7,9-13,19-20H,5-6,8,14-18,21H2
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50407300
PNG
(CHEMBL397705)
Show SMILES [#6]-[#6@@H]1-[#6@H]-2-[#6]-c3ccc(-[#8])cc3[C@]1([#6])[#6]-[#6]-[#7]-2-[#6]\[#6]=[#6](/[#6])-[#6] |r,TLB:16:15:1:10.4.3|
Show InChI InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14-,18-,19-/m1/s1
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n/an/a 8.90n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035106
PNG
(1'-{3-[1-(4-fluorophenyl)-1H-3-indolyl]propyl}spir...)
Show SMILES Fc1ccc(cc1)-n1cc(CCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C29H29FN2O/c30-24-11-13-25(14-12-24)32-20-22(26-8-2-4-10-28(26)32)7-5-17-31-18-15-29(16-19-31)27-9-3-1-6-23(27)21-33-29/h1-4,6,8-14,20H,5,7,15-19,21H2
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n/an/a 10n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035109
PNG
(1'-{4-[1-(4-methylphenylsulfonyl)-1H-3-indolyl]but...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C31H34N2O3S/c1-24-13-15-27(16-14-24)37(34,35)33-22-25(28-10-3-5-12-30(28)33)8-6-7-19-32-20-17-31(18-21-32)29-11-4-2-9-26(29)23-36-31/h2-5,9-16,22H,6-8,17-21,23H2,1H3
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035099
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-butyl}-1...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C22H26FN3/c23-19-8-10-20(11-9-19)26-15-13-25(14-16-26)12-4-3-5-18-17-24-22-7-2-1-6-21(18)22/h1-2,6-11,17,24H,3-5,12-16H2
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n/an/a 14n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035112
PNG
(1'-{4-[1-(4-pyridyl)-1H-3-indolyl]butyl}spiro[1,3-...)
Show SMILES C(CCc1cn(-c2ccncc2)c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Show InChI InChI=1S/C29H31N3O/c1-3-10-27-24(8-1)22-33-29(27)14-19-31(20-15-29)18-6-5-7-23-21-32(25-12-16-30-17-13-25)28-11-4-2-9-26(23)28/h1-4,8-13,16-17,21H,5-7,14-15,18-20,22H2
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n/an/a 14n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035107
PNG
(1'-{4-[1-(1,3-thiazol-2-yl)-1H-3-indolyl]butyl}spi...)
Show SMILES C(CCc1cn(-c2nccs2)c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Show InChI InChI=1S/C27H29N3OS/c1-3-10-24-22(8-1)20-31-27(24)12-16-29(17-13-27)15-6-5-7-21-19-30(26-28-14-18-32-26)25-11-4-2-9-23(21)25/h1-4,8-11,14,18-19H,5-7,12-13,15-17,20H2
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n/an/a 14n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035094
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C23H29N3O/c1-27-23-12-5-4-11-22(23)26-16-14-25(15-17-26)13-7-6-8-19-18-24-21-10-3-2-9-20(19)21/h2-5,9-12,18,24H,6-8,13-17H2,1H3
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n/an/a 14n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035094
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C23H29N3O/c1-27-23-12-5-4-11-22(23)26-16-14-25(15-17-26)13-7-6-8-19-18-24-21-10-3-2-9-20(19)21/h2-5,9-12,18,24H,6-8,13-17H2,1H3
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n/an/a 15n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035116
PNG
(1'-{2-[1-(4-fluorophenyl)-1H-3-indolyl]ethyl}spiro...)
Show SMILES Fc1ccc(cc1)-n1cc(CCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C28H27FN2O/c29-23-9-11-24(12-10-23)31-19-21(25-6-2-4-8-27(25)31)13-16-30-17-14-28(15-18-30)26-7-3-1-5-22(26)20-32-28/h1-12,19H,13-18,20H2
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n/an/a 15n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035102
PNG
(1-(4-Fluoro-phenyl)-3-{4-[4-(4-fluoro-phenyl)-pipe...)
Show SMILES Fc1ccc(cc1)C1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Show InChI InChI=1S/C29H30F2N2/c30-25-10-8-22(9-11-25)23-16-19-32(20-17-23)18-4-3-5-24-21-33(27-14-12-26(31)13-15-27)29-7-2-1-6-28(24)29/h1-2,6-15,21,23H,3-5,16-20H2
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n/an/a 16n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035105
PNG
(1'-{4-[1-(4-fluorophenyl)-1H-3-indolyl]butyl}spiro...)
Show SMILES Fc1ccc(cc1)-n1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C30H31FN2O/c31-25-12-14-26(15-13-25)33-21-23(27-9-2-4-11-29(27)33)7-5-6-18-32-19-16-30(17-20-32)28-10-3-1-8-24(28)22-34-30/h1-4,8-15,21H,5-7,16-20,22H2
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n/an/a 17n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035094
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C23H29N3O/c1-27-23-12-5-4-11-22(23)26-16-14-25(15-17-26)13-7-6-8-19-18-24-21-10-3-2-9-20(19)21/h2-5,9-12,18,24H,6-8,13-17H2,1H3
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n/an/a 17n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035096
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperidin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1C1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C24H30N2O/c1-27-24-12-5-3-10-22(24)19-13-16-26(17-14-19)15-7-6-8-20-18-25-23-11-4-2-9-21(20)23/h2-5,9-12,18-19,25H,6-8,13-17H2,1H3
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n/an/a 20n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50002164
PNG
(3-[4-(4-Phenyl-piperidin-1-yl)-butyl]-1H-indole | ...)
Show SMILES C(CCc1c[nH]c2ccccc12)CN1CCC(CC1)c1ccccc1
Show InChI InChI=1S/C23H28N2/c1-2-8-19(9-3-1)20-13-16-25(17-14-20)15-7-6-10-21-18-24-23-12-5-4-11-22(21)23/h1-5,8-9,11-12,18,20,24H,6-7,10,13-17H2
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n/an/a 25n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035113
PNG
(1-(4-Fluoro-phenyl)-3-[4-(4-phenyl-piperazin-1-yl)...)
Show SMILES Fc1ccc(cc1)-n1cc(CCCCN2CCN(CC2)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C28H30FN3/c29-24-13-15-26(16-14-24)32-22-23(27-11-4-5-12-28(27)32)8-6-7-17-30-18-20-31(21-19-30)25-9-2-1-3-10-25/h1-5,9-16,22H,6-8,17-21H2
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n/an/a 27n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50002171
PNG
(3-{4-[4-(4-Fluoro-phenyl)-3,6-dihydro-2H-pyridin-1...)
Show SMILES Fc1ccc(cc1)C1=CCN(CCCCc2c[nH]c3ccccc23)CC1 |t:8|
Show InChI InChI=1S/C23H25FN2/c24-21-10-8-18(9-11-21)19-12-15-26(16-13-19)14-4-3-5-20-17-25-23-7-2-1-6-22(20)23/h1-2,6-12,17,25H,3-5,13-16H2
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n/an/a 27n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035108
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperidin-1-yl]-butyl}-1...)
Show SMILES Fc1ccc(cc1)C1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C23H27FN2/c24-21-10-8-18(9-11-21)19-12-15-26(16-13-19)14-4-3-5-20-17-25-23-7-2-1-6-22(20)23/h1-2,6-11,17,19,25H,3-5,12-16H2
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035108
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperidin-1-yl]-butyl}-1...)
Show SMILES Fc1ccc(cc1)C1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C23H27FN2/c24-21-10-8-18(9-11-21)19-12-15-26(16-13-19)14-4-3-5-20-17-25-23-7-2-1-6-22(20)23/h1-2,6-11,17,19,25H,3-5,12-16H2
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n/an/a 34n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM81982
PNG
(CAS_97-39-2 | DITOLYLGUANIDINE | DTG | Di-o-tolylg...)
Show SMILES Cc1ccccc1NC(N)=Nc1ccccc1C |w:10.11|
Show InChI InChI=1S/C15H17N3/c1-11-7-3-5-9-13(11)17-15(16)18-14-10-6-4-8-12(14)2/h3-10H,1-2H3,(H3,16,17,18)
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n/an/a 36n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035099
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-butyl}-1...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C22H26FN3/c23-19-8-10-20(11-9-19)26-15-13-25(14-16-26)12-4-3-5-18-17-24-22-7-2-1-6-21(18)22/h1-2,6-11,17,24H,3-5,12-16H2
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n/an/a 37n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035117
PNG
(1-(4-Fluoro-phenyl)-3-[4-(4-phenyl-piperidin-1-yl)...)
Show SMILES Fc1ccc(cc1)-n1cc(CCCCN2CCC(CC2)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C29H31FN2/c30-26-13-15-27(16-14-26)32-22-25(28-11-4-5-12-29(28)32)10-6-7-19-31-20-17-24(18-21-31)23-8-2-1-3-9-23/h1-5,8-9,11-16,22,24H,6-7,10,17-21H2
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n/an/a 44n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50002164
PNG
(3-[4-(4-Phenyl-piperidin-1-yl)-butyl]-1H-indole | ...)
Show SMILES C(CCc1c[nH]c2ccccc12)CN1CCC(CC1)c1ccccc1
Show InChI InChI=1S/C23H28N2/c1-2-8-19(9-3-1)20-13-16-25(17-14-20)15-7-6-10-21-18-24-23-12-5-4-11-22(21)23/h1-5,8-9,11-12,18,20,24H,6-7,10,13-17H2
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n/an/a 45n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50002171
PNG
(3-{4-[4-(4-Fluoro-phenyl)-3,6-dihydro-2H-pyridin-1...)
Show SMILES Fc1ccc(cc1)C1=CCN(CCCCc2c[nH]c3ccccc23)CC1 |t:8|
Show InChI InChI=1S/C23H25FN2/c24-21-10-8-18(9-11-21)19-12-15-26(16-13-19)14-4-3-5-20-17-25-23-7-2-1-6-22(20)23/h1-2,6-12,17,25H,3-5,13-16H2
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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n/an/a 55n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035096
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperidin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1C1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C24H30N2O/c1-27-24-12-5-3-10-22(24)19-13-16-26(17-14-19)15-7-6-8-20-18-25-23-11-4-2-9-21(20)23/h2-5,9-12,18-19,25H,6-8,13-17H2,1H3
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n/an/a 56n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50002238
PNG
((R)1-(4-Fluoro-phenyl)-4-[4-(5-fluoro-pyrimidin-2-...)
Show SMILES OC(CCCN1CCN(CC1)c1ncc(F)cn1)c1ccc(F)cc1
Show InChI InChI=1S/C18H22F2N4O/c19-15-5-3-14(4-6-15)17(25)2-1-7-23-8-10-24(11-9-23)18-21-12-16(20)13-22-18/h3-6,12-13,17,25H,1-2,7-11H2
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n/an/a 60n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50002218
PNG
(2-(1-Cyclopropylmethyl-piperidin-4-yl)-1-(4-fluoro...)
Show SMILES Fc1ccc(cc1)C(=O)CC1CCN(CC2CC2)CC1
Show InChI InChI=1S/C17H22FNO/c18-16-5-3-15(4-6-16)17(20)11-13-7-9-19(10-8-13)12-14-1-2-14/h3-6,13-14H,1-2,7-12H2
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n/an/a 66n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50002171
PNG
(3-{4-[4-(4-Fluoro-phenyl)-3,6-dihydro-2H-pyridin-1...)
Show SMILES Fc1ccc(cc1)C1=CCN(CCCCc2c[nH]c3ccccc23)CC1 |t:8|
Show InChI InChI=1S/C23H25FN2/c24-21-10-8-18(9-11-21)19-12-15-26(16-13-19)14-4-3-5-20-17-25-23-7-2-1-6-22(20)23/h1-2,6-12,17,25H,3-5,13-16H2
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n/an/a 71n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035096
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperidin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1C1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C24H30N2O/c1-27-24-12-5-3-10-22(24)19-13-16-26(17-14-19)15-7-6-8-20-18-25-23-11-4-2-9-21(20)23/h2-5,9-12,18-19,25H,6-8,13-17H2,1H3
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n/an/a 83n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50002164
PNG
(3-[4-(4-Phenyl-piperidin-1-yl)-butyl]-1H-indole | ...)
Show SMILES C(CCc1c[nH]c2ccccc12)CN1CCC(CC1)c1ccccc1
Show InChI InChI=1S/C23H28N2/c1-2-8-19(9-3-1)20-13-16-25(17-14-20)15-7-6-10-21-18-24-23-12-5-4-11-22(21)23/h1-5,8-9,11-12,18,20,24H,6-7,10,13-17H2
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n/an/a 110n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035101
PNG
(1'-[4-(1H-3-indolyl)butyl]spiro[1,3-dihydroisobenz...)
Show SMILES C(CCc1c[nH]c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Show InChI InChI=1S/C24H28N2O/c1-3-10-22-20(8-1)18-27-24(22)12-15-26(16-13-24)14-6-5-7-19-17-25-23-11-4-2-9-21(19)23/h1-4,8-11,17,25H,5-7,12-16,18H2
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035094
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C23H29N3O/c1-27-23-12-5-4-11-22(23)26-16-14-25(15-17-26)13-7-6-8-19-18-24-21-10-3-2-9-20(19)21/h2-5,9-12,18,24H,6-8,13-17H2,1H3
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n/an/a 150n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035108
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperidin-1-yl]-butyl}-1...)
Show SMILES Fc1ccc(cc1)C1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C23H27FN2/c24-21-10-8-18(9-11-21)19-12-15-26(16-13-19)14-4-3-5-20-17-25-23-7-2-1-6-22(20)23/h1-2,6-11,17,19,25H,3-5,12-16H2
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n/an/a 160n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035099
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-butyl}-1...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C22H26FN3/c23-19-8-10-20(11-9-19)26-15-13-25(14-16-26)12-4-3-5-18-17-24-22-7-2-1-6-21(18)22/h1-2,6-11,17,24H,3-5,12-16H2
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n/an/a 180n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035104
PNG
(1-(4-Fluoro-phenyl)-3-{4-[4-(4-fluoro-phenyl)-pipe...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Show InChI InChI=1S/C28H29F2N3/c29-23-8-12-25(13-9-23)32-19-17-31(18-20-32)16-4-3-5-22-21-33(26-14-10-24(30)11-15-26)28-7-2-1-6-27(22)28/h1-2,6-15,21H,3-5,16-20H2
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035102
PNG
(1-(4-Fluoro-phenyl)-3-{4-[4-(4-fluoro-phenyl)-pipe...)
Show SMILES Fc1ccc(cc1)C1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Show InChI InChI=1S/C29H30F2N2/c30-25-10-8-22(9-11-25)23-16-19-32(20-17-23)18-4-3-5-24-21-33(27-14-12-26(31)13-15-27)29-7-2-1-6-28(24)29/h1-2,6-15,21,23H,3-5,16-20H2
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n/an/a 270n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50002238
PNG
((R)1-(4-Fluoro-phenyl)-4-[4-(5-fluoro-pyrimidin-2-...)
Show SMILES OC(CCCN1CCN(CC1)c1ncc(F)cn1)c1ccc(F)cc1
Show InChI InChI=1S/C18H22F2N4O/c19-15-5-3-14(4-6-15)17(25)2-1-7-23-8-10-24(11-9-23)18-21-12-16(20)13-22-18/h3-6,12-13,17,25H,1-2,7-11H2
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n/an/a 320n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035101
PNG
(1'-[4-(1H-3-indolyl)butyl]spiro[1,3-dihydroisobenz...)
Show SMILES C(CCc1c[nH]c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Show InChI InChI=1S/C24H28N2O/c1-3-10-22-20(8-1)18-27-24(22)12-15-26(16-13-24)14-6-5-7-19-17-25-23-11-4-2-9-21(19)23/h1-4,8-11,17,25H,5-7,12-16,18H2
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035104
PNG
(1-(4-Fluoro-phenyl)-3-{4-[4-(4-fluoro-phenyl)-pipe...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Show InChI InChI=1S/C28H29F2N3/c29-23-8-12-25(13-9-23)32-19-17-31(18-20-32)16-4-3-5-22-21-33(26-14-10-24(30)11-15-26)28-7-2-1-6-27(22)28/h1-2,6-15,21H,3-5,16-20H2
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n/an/a 440n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50002218
PNG
(2-(1-Cyclopropylmethyl-piperidin-4-yl)-1-(4-fluoro...)
Show SMILES Fc1ccc(cc1)C(=O)CC1CCN(CC2CC2)CC1
Show InChI InChI=1S/C17H22FNO/c18-16-5-3-15(4-6-16)17(20)11-13-7-9-19(10-8-13)12-14-1-2-14/h3-6,13-14H,1-2,7-12H2
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n/an/a 640n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50019742
PNG
(9-(3-((3S,5R)-3,5-dimethylpiperazin-1-yl)propyl)-9...)
Show SMILES C[C@H]1CN(CCCn2c3ccccc3c3ccccc23)C[C@@H](C)N1 |r|
Show InChI InChI=1S/C21H27N3/c1-16-14-23(15-17(2)22-16)12-7-13-24-20-10-5-3-8-18(20)19-9-4-6-11-21(19)24/h3-6,8-11,16-17,22H,7,12-15H2,1-2H3/t16-,17+
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n/an/a 690n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035105
PNG
(1'-{4-[1-(4-fluorophenyl)-1H-3-indolyl]butyl}spiro...)
Show SMILES Fc1ccc(cc1)-n1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C30H31FN2O/c31-25-12-14-26(15-13-25)33-21-23(27-9-2-4-11-29(27)33)7-5-6-18-32-19-16-30(17-20-32)28-10-3-1-8-24(28)22-34-30/h1-4,8-15,21H,5-7,16-20,22H2
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H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50002238
PNG
((R)1-(4-Fluoro-phenyl)-4-[4-(5-fluoro-pyrimidin-2-...)
Show SMILES OC(CCCN1CCN(CC1)c1ncc(F)cn1)c1ccc(F)cc1
Show InChI InChI=1S/C18H22F2N4O/c19-15-5-3-14(4-6-15)17(25)2-1-7-23-8-10-24(11-9-23)18-21-12-16(20)13-22-18/h3-6,12-13,17,25H,1-2,7-11H2
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n/an/a 830n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)		BDBM50035098
PNG
(1-(4-Fluoro-phenyl)-3-{4-[3-(4-fluoro-phenyl)-8-az...)
Show SMILES Fc1ccc(cc1)C1=CC2CCC(C1)N2CCCCc1cn(-c2ccc(F)cc2)c2ccccc12 |t:8|
Show InChI InChI=1S/C31H30F2N2/c32-25-10-8-22(9-11-25)24-19-28-16-17-29(20-24)34(28)18-4-3-5-23-21-35(27-14-12-26(33)13-15-27)31-7-2-1-6-30(23)31/h1-2,6-15,19,21,28-29H,3-5,16-18,20H2
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n/an/a 1.20E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor binding site 1 using [3H](+)-pentazocine

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035101
PNG
(1'-[4-(1H-3-indolyl)butyl]spiro[1,3-dihydroisobenz...)
Show SMILES C(CCc1c[nH]c2ccccc12)CN1CCC2(CC1)OCc1ccccc21
Show InChI InChI=1S/C24H28N2O/c1-3-10-22-20(8-1)18-27-24(22)12-15-26(16-13-24)14-6-5-7-19-17-25-23-11-4-2-9-21(19)23/h1-4,8-11,17,25H,5-7,12-16,18H2
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n/an/a 1.30E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035105
PNG
(1'-{4-[1-(4-fluorophenyl)-1H-3-indolyl]butyl}spiro...)
Show SMILES Fc1ccc(cc1)-n1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C30H31FN2O/c31-25-12-14-26(15-13-25)33-21-23(27-9-2-4-11-29(27)33)7-5-6-18-32-19-16-30(17-20-32)28-10-3-1-8-24(28)22-34-30/h1-4,8-15,21H,5-7,16-20,22H2
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n/an/a 2.00E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035104
PNG
(1-(4-Fluoro-phenyl)-3-{4-[4-(4-fluoro-phenyl)-pipe...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Show InChI InChI=1S/C28H29F2N3/c29-23-8-12-25(13-9-23)32-19-17-31(18-20-32)16-4-3-5-22-21-33(26-14-10-24(30)11-15-26)28-7-2-1-6-27(22)28/h1-2,6-15,21H,3-5,16-20H2
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n/an/a 3.00E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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n/an/a 3.20E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035097
PNG
(1''-benzyl-3,4-dihydro-2H-spiro[naphthalene-1,4''-...)
Show SMILES C(N1CCC2(CCCc3ccccc23)CC1)c1ccccc1
Show InChI InChI=1S/C21H25N/c1-2-7-18(8-3-1)17-22-15-13-21(14-16-22)12-6-10-19-9-4-5-11-20(19)21/h1-5,7-9,11H,6,10,12-17H2
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n/an/a 3.70E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035098
PNG
(1-(4-Fluoro-phenyl)-3-{4-[3-(4-fluoro-phenyl)-8-az...)
Show SMILES Fc1ccc(cc1)C1=CC2CCC(C1)N2CCCCc1cn(-c2ccc(F)cc2)c2ccccc12 |t:8|
Show InChI InChI=1S/C31H30F2N2/c32-25-10-8-22(9-11-25)24-19-28-16-17-29(20-24)34(28)18-4-3-5-23-21-35(27-14-12-26(33)13-15-27)31-7-2-1-6-30(23)31/h1-2,6-15,19,21,28-29H,3-5,16-18,20H2
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n/an/a 3.70E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035102
PNG
(1-(4-Fluoro-phenyl)-3-{4-[4-(4-fluoro-phenyl)-pipe...)
Show SMILES Fc1ccc(cc1)C1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Show InChI InChI=1S/C29H30F2N2/c30-25-10-8-22(9-11-25)23-16-19-32(20-17-23)18-4-3-5-24-21-33(27-14-12-26(31)13-15-27)29-7-2-1-6-28(24)29/h1-2,6-15,21,23H,3-5,16-20H2
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n/an/a 4.20E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50035097
PNG
(1''-benzyl-3,4-dihydro-2H-spiro[naphthalene-1,4''-...)
Show SMILES C(N1CCC2(CCCc3ccccc23)CC1)c1ccccc1
Show InChI InChI=1S/C21H25N/c1-2-7-18(8-3-1)17-22-15-13-21(14-16-22)12-6-10-19-9-4-5-11-20(19)21/h1-5,7-9,11H,6,10,12-17H2
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n/an/a 7.10E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 2A receptor binding site using [3H]ketanserin .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50035098
PNG
(1-(4-Fluoro-phenyl)-3-{4-[3-(4-fluoro-phenyl)-8-az...)
Show SMILES Fc1ccc(cc1)C1=CC2CCC(C1)N2CCCCc1cn(-c2ccc(F)cc2)c2ccccc12 |t:8|
Show InChI InChI=1S/C31H30F2N2/c32-25-10-8-22(9-11-25)24-19-28-16-17-29(20-24)34(28)18-4-3-5-23-21-35(27-14-12-26(33)13-15-27)31-7-2-1-6-30(23)31/h1-2,6-15,19,21,28-29H,3-5,16-18,20H2
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n/an/a 8.00E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))		BDBM50002238
PNG
((R)1-(4-Fluoro-phenyl)-4-[4-(5-fluoro-pyrimidin-2-...)
Show SMILES OC(CCCN1CCN(CC1)c1ncc(F)cn1)c1ccc(F)cc1
Show InChI InChI=1S/C18H22F2N4O/c19-15-5-3-14(4-6-15)17(25)2-1-7-23-8-10-24(11-9-23)18-21-12-16(20)13-22-18/h3-6,12-13,17,25H,1-2,7-11H2
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n/an/a 8.40E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 binding site using [3H]spiroperidol.

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035104
PNG
(1-(4-Fluoro-phenyl)-3-{4-[4-(4-fluoro-phenyl)-pipe...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Show InChI InChI=1S/C28H29F2N3/c29-23-8-12-25(13-9-23)32-19-17-31(18-20-32)16-4-3-5-22-21-33(26-14-10-24(30)11-15-26)28-7-2-1-6-27(22)28/h1-2,6-15,21H,3-5,16-20H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035098
PNG
(1-(4-Fluoro-phenyl)-3-{4-[3-(4-fluoro-phenyl)-8-az...)
Show SMILES Fc1ccc(cc1)C1=CC2CCC(C1)N2CCCCc1cn(-c2ccc(F)cc2)c2ccccc12 |t:8|
Show InChI InChI=1S/C31H30F2N2/c32-25-10-8-22(9-11-25)24-19-28-16-17-29(20-24)34(28)18-4-3-5-23-21-35(27-14-12-26(33)13-15-27)31-7-2-1-6-30(23)31/h1-2,6-15,19,21,28-29H,3-5,16-18,20H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035105
PNG
(1'-{4-[1-(4-fluorophenyl)-1H-3-indolyl]butyl}spiro...)
Show SMILES Fc1ccc(cc1)-n1cc(CCCCN2CCC3(CC2)OCc2ccccc32)c2ccccc12
Show InChI InChI=1S/C30H31FN2O/c31-25-12-14-26(15-13-25)33-21-23(27-9-2-4-11-29(27)33)7-5-6-18-32-19-16-30(17-20-32)28-10-3-1-8-24(28)22-34-30/h1-4,8-15,21H,5-7,16-20,22H2
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n/an/a 2.10E+4n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035102
PNG
(1-(4-Fluoro-phenyl)-3-{4-[4-(4-fluoro-phenyl)-pipe...)
Show SMILES Fc1ccc(cc1)C1CCN(CCCCc2cn(-c3ccc(F)cc3)c3ccccc23)CC1
Show InChI InChI=1S/C29H30F2N2/c30-25-10-8-22(9-11-25)23-16-19-32(20-17-23)18-4-3-5-24-21-33(27-14-12-26(31)13-15-27)29-7-2-1-6-28(24)29/h1-2,6-15,21,23H,3-5,16-20H2
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n/an/a 2.20E+4n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50002218
PNG
(2-(1-Cyclopropylmethyl-piperidin-4-yl)-1-(4-fluoro...)
Show SMILES Fc1ccc(cc1)C(=O)CC1CCN(CC2CC2)CC1
Show InChI InChI=1S/C17H22FNO/c18-16-5-3-15(4-6-16)17(20)11-13-7-9-19(10-8-13)12-14-1-2-14/h3-6,13-14H,1-2,7-12H2
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n/an/a 4.40E+4n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))		BDBM50035097
PNG
(1''-benzyl-3,4-dihydro-2H-spiro[naphthalene-1,4''-...)
Show SMILES C(N1CCC2(CCCc3ccccc23)CC1)c1ccccc1
Show InChI InChI=1S/C21H25N/c1-2-7-18(8-3-1)17-22-15-13-21(14-16-22)12-6-10-19-9-4-5-11-20(19)21/h1-5,7-9,11H,6,10,12-17H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor binding site using [3H]8-OH-DPAT .

J Med Chem 38: 1998-2008 (1995)


BindingDB Entry DOI: 10.7270/Q2SJ1M8P
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%