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BDBM50189854 6-bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl]imidazo[1,2-a]pyridine::CHEMBL211164

SMILES: COc1ccccc1N1CCN(Cc2cn3cc(Br)ccc3n2)CC1

InChI Key: InChIKey=OZGYKPPQUQUAJA-UHFFFAOYSA-N

Data: 7 KI

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 7 hits for monomerid = 50189854   
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))
BDBM50189854
PNG
(6-bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3cc(Br)ccc3n2)CC1
Show InChI InChI=1S/C19H21BrN4O/c1-25-18-5-3-2-4-17(18)23-10-8-22(9-11-23)13-16-14-24-12-15(20)6-7-19(24)21-16/h2-7,12,14H,8-11,13H2,1H3
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0.25n/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(4) dopamine receptor


(Homo sapiens (Human))
BDBM50189854
PNG
(6-bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3cc(Br)ccc3n2)CC1
Show InChI InChI=1S/C19H21BrN4O/c1-25-18-5-3-2-4-17(18)23-10-8-22(9-11-23)13-16-14-24-12-15(20)6-7-19(24)21-16/h2-7,12,14H,8-11,13H2,1H3
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0.25n/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))
BDBM50189854
PNG
(6-bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3cc(Br)ccc3n2)CC1
Show InChI InChI=1S/C19H21BrN4O/c1-25-18-5-3-2-4-17(18)23-10-8-22(9-11-23)13-16-14-24-12-15(20)6-7-19(24)21-16/h2-7,12,14H,8-11,13H2,1H3
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0.25n/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(2) dopamine receptor


(Homo sapiens (Human))
BDBM50189854
PNG
(6-bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3cc(Br)ccc3n2)CC1
Show InChI InChI=1S/C19H21BrN4O/c1-25-18-5-3-2-4-17(18)23-10-8-22(9-11-23)13-16-14-24-12-15(20)6-7-19(24)21-16/h2-7,12,14H,8-11,13H2,1H3
PDB

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130n/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
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50189854
PNG
(6-bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3cc(Br)ccc3n2)CC1
Show InChI InChI=1S/C19H21BrN4O/c1-25-18-5-3-2-4-17(18)23-10-8-22(9-11-23)13-16-14-24-12-15(20)6-7-19(24)21-16/h2-7,12,14H,8-11,13H2,1H3
PDB

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140n/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(3) dopamine receptor


(Homo sapiens (Human))
BDBM50189854
PNG
(6-bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3cc(Br)ccc3n2)CC1
Show InChI InChI=1S/C19H21BrN4O/c1-25-18-5-3-2-4-17(18)23-10-8-22(9-11-23)13-16-14-24-12-15(20)6-7-19(24)21-16/h2-7,12,14H,8-11,13H2,1H3
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800n/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
Dopamine D1 receptor


(Sus scrofa)
BDBM50189854
PNG
(6-bromo-2-[4-(2-methoxyphenyl)piperazin-1-ylmethyl...)
Show SMILES COc1ccccc1N1CCN(Cc2cn3cc(Br)ccc3n2)CC1
Show InChI InChI=1S/C19H21BrN4O/c1-25-18-5-3-2-4-17(18)23-10-8-22(9-11-23)13-16-14-24-12-15(20)6-7-19(24)21-16/h2-7,12,14H,8-11,13H2,1H3
PDB

KEGG

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7.10E+3n/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