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BDBM50102325 6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepine::CHEMBL340801::Perlapine

SMILES: CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12

InChI Key: InChIKey=PWRPUAKXMQAFCJ-UHFFFAOYSA-N

Data: 16 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 50102325   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dopamine receptor


(RAT)
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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PubMed
7.90n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




Psychopharmacology (Berl) 120: 365-8 (1995)


Article DOI: 10.1007/bf02311185
BindingDB Entry DOI: 10.7270/Q2VT1QKB
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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12.5n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




Psychopharmacology (Berl) 120: 365-8 (1995)


Article DOI: 10.1007/bf02311185
BindingDB Entry DOI: 10.7270/Q2VT1QKB
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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12.6n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 1403-10 (1994)


BindingDB Entry DOI: 10.7270/Q2154FJQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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13n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Mol Psychiatry 3: 123-34 (1998)


BindingDB Entry DOI: 10.7270/Q2G15ZCQ
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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28n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 1403-10 (1994)


BindingDB Entry DOI: 10.7270/Q2154FJQ
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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30n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Mol Psychiatry 3: 123-34 (1998)


BindingDB Entry DOI: 10.7270/Q2G15ZCQ
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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30n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Neuropsychopharmacology 16: 93 (1997)


Article DOI: 10.1016/S0893-133X(96)00187-X
BindingDB Entry DOI: 10.7270/Q2513WR8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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30n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Neuropsychopharmacology 16: 93 (1997)


Article DOI: 10.1016/S0893-133X(96)00187-X
BindingDB Entry DOI: 10.7270/Q2513WR8
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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60n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Neuropsychopharmacology 16: 93 (1997)


Article DOI: 10.1016/S0893-133X(96)00187-X
BindingDB Entry DOI: 10.7270/Q2513WR8
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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60n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Mol Psychiatry 3: 123-34 (1998)


BindingDB Entry DOI: 10.7270/Q2G15ZCQ
More data for this
Ligand-Target Pair
HTR6


(RAT)
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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70n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 1403-10 (1994)


BindingDB Entry DOI: 10.7270/Q2154FJQ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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100n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Mol Psychiatry 3: 123-34 (1998)


BindingDB Entry DOI: 10.7270/Q2G15ZCQ
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (Human))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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150n/an/an/an/an/an/an/an/a



University of Washington

Curated by PDSP Ki Database




J Neurochem 66: 47-56 (1996)


Article DOI: 10.1046/j.1471-4159.1996.66010047.x
BindingDB Entry DOI: 10.7270/Q20K2721
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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501n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




Psychopharmacology (Berl) 120: 365-8 (1995)


Article DOI: 10.1007/bf02311185
BindingDB Entry DOI: 10.7270/Q2VT1QKB
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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501n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 1403-10 (1994)


BindingDB Entry DOI: 10.7270/Q2154FJQ
More data for this
Ligand-Target Pair
Dopamine receptor


(Rattus norvegicus (Rat))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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919n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by PDSP Ki Database




J Pharmacol Exp Ther 264: 1002-11 (1993)


BindingDB Entry DOI: 10.7270/Q2T1525C
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50102325
PNG
(6-(4-Methyl-piperazin-1-yl)-11H-dibenzo[b,e]azepin...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Cc2ccccc12
Show InChI InChI=1S/C19H21N3/c1-21-10-12-22(13-11-21)19-17-8-4-2-6-15(17)14-16-7-3-5-9-18(16)20-19/h2-9H,10-14H2,1H3
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n/an/a 2.70E+3n/an/an/an/an/an/a



AstraZeneca Pharmaceuticals LP

Curated by ChEMBL


Assay Description
Inhibition of spiropiperidone binding at dopamine receptor D2 of rat.


J Med Chem 44: 372-89 (2001)


Article DOI: 10.1021/jm000242+
BindingDB Entry DOI: 10.7270/Q2639P1N
More data for this
Ligand-Target Pair