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Compile Data Set for Download or QSAR

Found 255 hits with Last Name = 'damas' and Initial = 'j'   
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
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)
BDBM50040237
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f]...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Sc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3
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0.600n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
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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0.870n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Binding affinity against dopamine D2 receptor


J Med Chem 37: 519-25 (1994)


BindingDB Entry DOI: 10.7270/Q2HX1DWK
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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0.880n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine D2 receptor in rat striatal tissue.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)
BDBM50010594
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-5H-dibenzo[b...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-12-13(19)6-7-15(14)20-16-4-2-3-5-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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1.80n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50001888
PNG
((chloropromazine) [3-(2-Chloro-phenothiazin-10-yl)...)
Show SMILES CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3
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2n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine D2 receptor in rat striatal tissue.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50001888
PNG
((chloropromazine) [3-(2-Chloro-phenothiazin-10-yl)...)
Show SMILES CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3
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2n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Binding affinity against dopamine D2 receptor


J Med Chem 37: 519-25 (1994)


BindingDB Entry DOI: 10.7270/Q2HX1DWK
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
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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2.20n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned Dopamine receptor D4 expressed in Sf9 cell membranes


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)
BDBM50001888
PNG
((chloropromazine) [3-(2-Chloro-phenothiazin-10-yl)...)
Show SMILES CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3
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3.30n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)
BDBM50040241
PNG
(3-Fluoro-6-(4-methyl-piperazin-1-yl)-11H-dibenzo[b...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(F)ccc2Cc2ccccc12 |t:8|
Show InChI InChI=1S/C19H20FN3/c1-22-8-10-23(11-9-22)19-17-5-3-2-4-14(17)12-15-6-7-16(20)13-18(15)21-19/h2-7,13H,8-12H2,1H3
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3.80n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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3.80n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)
BDBM50040243
PNG
(8-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f]...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Sc2ccccc12 |t:8|
Show InChI InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-4-2-3-5-16(14)23-17-7-6-13(19)12-15(17)20-18/h2-7,12H,8-11H2,1H3
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4.10n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50040237
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f]...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Sc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3
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4.40n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine D2 receptor in rat striatal tissue.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50040237
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f]...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Sc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3
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4.5n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Binding affinity against dopamine D2 receptor


J Med Chem 37: 519-25 (1994)


BindingDB Entry DOI: 10.7270/Q2HX1DWK
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50040243
PNG
(8-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f]...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Sc2ccccc12 |t:8|
Show InChI InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-4-2-3-5-16(14)23-17-7-6-13(19)12-15(17)20-18/h2-7,12H,8-11H2,1H3
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5.60n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Muscarinic acetylcholine receptors in rat brain.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)
BDBM50040250
PNG
(8-Chloro-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...)
Show SMILES CN1CCN(CC1)C1=Nc2cccnc2Nc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C17H18ClN5/c1-22-7-9-23(10-8-22)17-13-11-12(18)4-5-14(13)20-16-15(21-17)3-2-6-19-16/h2-6,11H,7-10H2,1H3,(H,19,20)
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6.20n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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6.70n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at serotonin 5-hydroxytryptamine 2A receptor in rat cortical membrane


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
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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8.5n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned Dopamine receptor D2L expressed in Sf9 cell membranes


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50010594
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-5H-dibenzo[b...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-12-13(19)6-7-15(14)20-16-4-2-3-5-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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13n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine D2 receptor in rat striatal tissue.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50010594
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-5H-dibenzo[b...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-12-13(19)6-7-15(14)20-16-4-2-3-5-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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13n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Binding affinity against dopamine D2 receptor


J Med Chem 37: 519-25 (1994)


BindingDB Entry DOI: 10.7270/Q2HX1DWK
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50040237
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f]...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Sc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3
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14n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Binding affinity against dopamine receptor D1


J Med Chem 37: 519-25 (1994)


BindingDB Entry DOI: 10.7270/Q2HX1DWK
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50040237
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f]...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Sc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3
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14n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine receptor D1 in rat striatal tissue


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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18n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned Dopamine receptor D4 expressed in Sf9 cell membranes


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50010594
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-5H-dibenzo[b...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-12-13(19)6-7-15(14)20-16-4-2-3-5-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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21n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Muscarinic acetylcholine receptors in rat brain.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-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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23n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50040250
PNG
(8-Chloro-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...)
Show SMILES CN1CCN(CC1)C1=Nc2cccnc2Nc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C17H18ClN5/c1-22-7-9-23(10-8-22)17-13-11-12(18)4-5-14(13)20-16-15(21-17)3-2-6-19-16/h2-6,11H,7-10H2,1H3,(H,19,20)
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24n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned Dopamine receptor D4 expressed in Sf9 cell membranes


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50040241
PNG
(3-Fluoro-6-(4-methyl-piperazin-1-yl)-11H-dibenzo[b...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(F)ccc2Cc2ccccc12 |t:8|
Show InChI InChI=1S/C19H20FN3/c1-22-8-10-23(11-9-22)19-17-5-3-2-4-14(17)12-15-6-7-16(20)13-18(15)21-19/h2-7,13H,8-12H2,1H3
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25n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Muscarinic acetylcholine receptors in rat brain.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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25n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Muscarinic acetylcholine receptors in rat brain.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50010594
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-5H-dibenzo[b...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-12-13(19)6-7-15(14)20-16-4-2-3-5-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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28n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Binding affinity against dopamine receptor D1


J Med Chem 37: 519-25 (1994)


BindingDB Entry DOI: 10.7270/Q2HX1DWK
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50010594
PNG
(2-Chloro-11-(4-methyl-piperazin-1-yl)-5H-dibenzo[b...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-12-13(19)6-7-15(14)20-16-4-2-3-5-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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28n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine receptor D1 in rat striatal tissue


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)
BDBM50040244
PNG
(11-(4-Methyl-piperazin-1-yl)-5H-benzo[b]pyrido[4,3...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2ccncc12 |t:8|
Show InChI InChI=1S/C17H19N5/c1-21-8-10-22(11-9-21)17-13-12-18-7-6-14(13)19-15-4-2-3-5-16(15)20-17/h2-7,12,19H,8-11H2,1H3
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29n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50040243
PNG
(8-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f]...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Sc2ccccc12 |t:8|
Show InChI InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-4-2-3-5-16(14)23-17-7-6-13(19)12-15(17)20-18/h2-7,12H,8-11H2,1H3
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30n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Binding affinity against dopamine D2 receptor


J Med Chem 37: 519-25 (1994)


BindingDB Entry DOI: 10.7270/Q2HX1DWK
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50040243
PNG
(8-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f]...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Sc2ccccc12 |t:8|
Show InChI InChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-4-2-3-5-16(14)23-17-7-6-13(19)12-15(17)20-18/h2-7,12H,8-11H2,1H3
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30n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine D2 receptor in rat striatal tissue.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50120943
PNG
(6-(4-Cyclohexyl-piperazin-1-yl)-8-methyl-11H-benzo...)
Show SMILES Cc1ccc2Nc3ncccc3N=C(N3CCN(CC3)C3CCCCC3)c2c1 |t:13|
Show InChI InChI=1S/C23H29N5/c1-17-9-10-20-19(16-17)23(26-21-8-5-11-24-22(21)25-20)28-14-12-27(13-15-28)18-6-3-2-4-7-18/h5,8-11,16,18H,2-4,6-7,12-15H2,1H3,(H,24,25)
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33n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at 5-hydroxytryptamine 2A receptor in rat cortical membrane


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50120934
PNG
((8-Benzyl-8-aza-bicyclo[3.2.1]oct-3-yl)-(8-methyl-...)
Show SMILES Cc1ccc2Nc3ncccc3N=C(NC3CC4CCC(C3)N4Cc3ccccc3)c2c1 |t:13|
Show InChI InChI=1S/C27H29N5/c1-18-9-12-24-23(14-18)26(31-25-8-5-13-28-27(25)30-24)29-20-15-21-10-11-22(16-20)32(21)17-19-6-3-2-4-7-19/h2-9,12-14,20-22H,10-11,15-17H2,1H3,(H,28,30)(H,29,31)
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34n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at 5-hydroxytryptamine 2A receptor in rat cortical membrane


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50120925
PNG
(8-Chloro-6-(4-cyclohexyl-piperazin-1-yl)-11H-benzo...)
Show SMILES Clc1ccc2Nc3ncccc3N=C(N3CCN(CC3)C3CCCCC3)c2c1 |t:13|
Show InChI InChI=1S/C22H26ClN5/c23-16-8-9-19-18(15-16)22(26-20-7-4-10-24-21(20)25-19)28-13-11-27(12-14-28)17-5-2-1-3-6-17/h4,7-10,15,17H,1-3,5-6,11-14H2,(H,24,25)
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34n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at 5-hydroxytryptamine 2A receptor in rat cortical membrane


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50001888
PNG
((chloropromazine) [3-(2-Chloro-phenothiazin-10-yl)...)
Show SMILES CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3
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35n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Binding affinity against dopamine receptor D1


J Med Chem 37: 519-25 (1994)


BindingDB Entry DOI: 10.7270/Q2HX1DWK
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50001888
PNG
((chloropromazine) [3-(2-Chloro-phenothiazin-10-yl)...)
Show SMILES CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3
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35n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine receptor D1 in rat striatal tissue


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50040250
PNG
(8-Chloro-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...)
Show SMILES CN1CCN(CC1)C1=Nc2cccnc2Nc2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C17H18ClN5/c1-22-7-9-23(10-8-22)17-13-11-12(18)4-5-14(13)20-16-15(21-17)3-2-6-19-16/h2-6,11H,7-10H2,1H3,(H,19,20)
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35n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at serotonin 5-hydroxytryptamine 2A receptor in rat cortical membrane


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50120938
PNG
((8-Benzyl-8-aza-bicyclo[3.2.1]oct-3-yl)-(8-chloro-...)
Show SMILES Clc1ccc2Nc3ncccc3N=C(NC3CC4CCC(C3)N4Cc3ccccc3)c2c1 |t:13|
Show InChI InChI=1S/C26H26ClN5/c27-18-8-11-23-22(13-18)25(31-24-7-4-12-28-26(24)30-23)29-19-14-20-9-10-21(15-19)32(20)16-17-5-2-1-3-6-17/h1-8,11-13,19-21H,9-10,14-16H2,(H,28,30)(H,29,31)
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36n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at 5-hydroxytryptamine 2A receptor in rat cortical membrane


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50040245
PNG
(8-Methyl-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...)
Show SMILES CN1CCN(CC1)C1=Nc2cccnc2Nc2ccc(C)cc12 |t:8|
Show InChI InChI=1S/C18H21N5/c1-13-5-6-15-14(12-13)18(23-10-8-22(2)9-11-23)21-16-4-3-7-19-17(16)20-15/h3-7,12H,8-11H2,1-2H3,(H,19,20)
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36n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned Dopamine receptor D4 expressed in Sf9 cell membranes


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50120921
PNG
(8-Methyl-6-(4-phenethyl-piperazin-1-yl)-11H-benzo[...)
Show SMILES Cc1ccc2Nc3ncccc3N=C(N3CCN(CCc4ccccc4)CC3)c2c1 |t:13|
Show InChI InChI=1S/C25H27N5/c1-19-9-10-22-21(18-19)25(28-23-8-5-12-26-24(23)27-22)30-16-14-29(15-17-30)13-11-20-6-3-2-4-7-20/h2-10,12,18H,11,13-17H2,1H3,(H,26,27)
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36n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at 5-hydroxytryptamine 2A receptor in rat cortical membrane


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50040245
PNG
(8-Methyl-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...)
Show SMILES CN1CCN(CC1)C1=Nc2cccnc2Nc2ccc(C)cc12 |t:8|
Show InChI InChI=1S/C18H21N5/c1-13-5-6-15-14(12-13)18(23-10-8-22(2)9-11-23)21-16-4-3-7-19-17(16)20-15/h3-7,12H,8-11H2,1-2H3,(H,19,20)
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37n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at serotonin 5-hydroxytryptamine 2A receptor in rat cortical membrane


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50120921
PNG
(8-Methyl-6-(4-phenethyl-piperazin-1-yl)-11H-benzo[...)
Show SMILES Cc1ccc2Nc3ncccc3N=C(N3CCN(CCc4ccccc4)CC3)c2c1 |t:13|
Show InChI InChI=1S/C25H27N5/c1-19-9-10-22-21(18-19)25(28-23-8-5-12-26-24(23)27-22)30-16-14-29(15-17-30)13-11-20-6-3-2-4-7-20/h2-10,12,18H,11,13-17H2,1H3,(H,26,27)
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37n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned Dopamine receptor D4 expressed in Sf9 cell membranes


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50120945
PNG
(8-Chloro-6-(4-phenethyl-piperazin-1-yl)-11H-benzo[...)
Show SMILES Clc1ccc2Nc3ncccc3N=C(N3CCN(CCc4ccccc4)CC3)c2c1 |t:13|
Show InChI InChI=1S/C24H24ClN5/c25-19-8-9-21-20(17-19)24(28-22-7-4-11-26-23(22)27-21)30-15-13-29(14-16-30)12-10-18-5-2-1-3-6-18/h1-9,11,17H,10,12-16H2,(H,26,27)
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40n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned Dopamine receptor D4 expressed in Sf9 cell membranes


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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45n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Dopamine D2 receptor in rat striatal tissue.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50120932
PNG
((1-Benzyl-piperidin-4-yl)-(8-methyl-11H-benzo[e]py...)
Show SMILES Cc1ccc2Nc3ncccc3N=C(NC3CCN(Cc4ccccc4)CC3)c2c1 |t:13|
Show InChI InChI=1S/C25H27N5/c1-18-9-10-22-21(16-18)24(29-23-8-5-13-26-25(23)28-22)27-20-11-14-30(15-12-20)17-19-6-3-2-4-7-19/h2-10,13,16,20H,11-12,14-15,17H2,1H3,(H,26,28)(H,27,29)
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46n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned Dopamine receptor D4 expressed in Sf9 cell membranes


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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46n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Binding affinity against dopamine D2 receptor


J Med Chem 37: 519-25 (1994)


BindingDB Entry DOI: 10.7270/Q2HX1DWK
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50120932
PNG
((1-Benzyl-piperidin-4-yl)-(8-methyl-11H-benzo[e]py...)
Show SMILES Cc1ccc2Nc3ncccc3N=C(NC3CCN(Cc4ccccc4)CC3)c2c1 |t:13|
Show InChI InChI=1S/C25H27N5/c1-18-9-10-22-21(16-18)24(29-23-8-5-13-26-25(23)28-22)27-20-11-14-30(15-12-20)17-19-6-3-2-4-7-19/h2-10,13,16,20H,11-12,14-15,17H2,1H3,(H,26,28)(H,27,29)
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48n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at 5-hydroxytryptamine 2A receptor in rat cortical membrane


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50120925
PNG
(8-Chloro-6-(4-cyclohexyl-piperazin-1-yl)-11H-benzo...)
Show SMILES Clc1ccc2Nc3ncccc3N=C(N3CCN(CC3)C3CCCCC3)c2c1 |t:13|
Show InChI InChI=1S/C22H26ClN5/c23-16-8-9-19-18(15-16)22(26-20-7-4-10-24-21(20)25-19)28-13-11-27(12-14-28)17-5-2-1-3-6-17/h4,7-10,15,17H,1-3,5-6,11-14H2,(H,24,25)
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48n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned Dopamine receptor D4 expressed in Sf9 cell membranes


J Med Chem 45: 5136-49 (2002)


BindingDB Entry DOI: 10.7270/Q2571BC1
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50040245
PNG
(8-Methyl-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]p...)
Show SMILES CN1CCN(CC1)C1=Nc2cccnc2Nc2ccc(C)cc12 |t:8|
Show InChI InChI=1S/C18H21N5/c1-13-5-6-15-14(12-13)18(23-10-8-22(2)9-11-23)21-16-4-3-7-19-17(16)20-15/h3-7,12H,8-11H2,1-2H3,(H,19,20)
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48n/an/an/an/an/an/an/an/a



University of Liège

Curated by ChEMBL


Assay Description
In vitro binding affinity against Muscarinic acetylcholine receptors in rat brain.


J Med Chem 36: 2107-14 (1993)


BindingDB Entry DOI: 10.7270/Q22B8X37
More data for this
Ligand-Target Pair
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