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BDBM50189845 2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo[1,2-a]pyridine::CHEMBL212631

SMILES: COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1

InChI Key: InChIKey=QGLGNPCWSBQHAU-UHFFFAOYSA-N

Data: 11 KI  2 EC50

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 13 hits for monomerid = 50189845   
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
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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2.80n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Agonist activity at dopamine D4 receptor (unknown origin)


Eur J Med Chem 181: (2019)


Article DOI: 10.1016/j.ejmech.2019.111569
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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2.80n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Agonist activity at dopamine D4 receptor (unknown origin)


Eur J Med Chem 181: (2019)


Article DOI: 10.1016/j.ejmech.2019.111569
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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2.80n/an/an/an/an/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine receptor D4.4 in CHO cell membrane


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
PDB

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110n/an/an/an/an/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Displacement of [3H]7-OH-DPAT from human dopamine receptor D2(long) in CHO cell membrane


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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400n/an/an/an/an/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Displacement of [3H]7-OH-DPAT from porcine dopamine receptor D2


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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930n/an/an/an/an/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine receptor D2(short) in CHO cell membrane


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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990n/an/an/an/an/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine receptor D2(long) in CHO cell membrane


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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2.20E+3n/an/an/an/an/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Displacement of [3H]8-OH-DPAT from 5HT1A receptor in porcine cortical membrane


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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3.90E+3n/an/an/an/an/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine receptor D3 in CHO cell membrane


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
5-HT2


(PIG)
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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5.90E+3n/an/an/an/an/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from 5HT2 receptor in porcine cortical membrane


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
Dopamine D1 receptor


(Sus scrofa)
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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2.00E+4n/an/an/an/an/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH 23990 from dopamine receptor D1 in porcine striatal membrane


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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n/an/an/an/a 3n/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Activity at human D4.2 receptor assessed as [3H]thymidine incorporation in CHO 10001 cells by mitogenesis assay


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50189845
PNG
(2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3ccccc3n2)CC1
Show InChI InChI=1S/C19H22N4O/c1-24-18-7-3-2-6-17(18)22-12-10-21(11-13-22)14-16-15-23-9-5-4-8-19(23)20-16/h2-9,15H,10-14H2,1H3
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n/an/an/an/a 4.5n/an/an/an/a



Laboratoire de Chimie Th�rapeutique

Curated by ChEMBL


Assay Description
Activity at human D4.4 receptor expressed in CHOK1 cells assessed as stimulation of [35S]GTP-gammaS binding


J Med Chem 49: 3938-47 (2006)


Article DOI: 10.1021/jm060166w
BindingDB Entry DOI: 10.7270/Q20G3KZ5
More data for this
Ligand-Target Pair