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SMILES: Cc1cccc(NC(=O)CN2CCN(CC2)c2ccc(F)cc2)c1

InChI Key: InChIKey=ZFHFDLWCYZLOQK-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50153266   
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))
BDBM50153266
PNG
(2-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-N-m-tolyl-a...)
Show SMILES Cc1cccc(NC(=O)CN2CCN(CC2)c2ccc(F)cc2)c1
Show InChI InChI=1S/C19H22FN3O/c1-15-3-2-4-17(13-15)21-19(24)14-22-9-11-23(12-10-22)18-7-5-16(20)6-8-18/h2-8,13H,9-12,14H2,1H3,(H,21,24)
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PC cid
PC sid
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Article
PubMed
61.9n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to inhibit [3H]-spiperone binding to human Dopamine receptor D4.4


Bioorg Med Chem Lett 14: 5095-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.068
BindingDB Entry DOI: 10.7270/Q23X863Q
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50153266
PNG
(2-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-N-m-tolyl-a...)
Show SMILES Cc1cccc(NC(=O)CN2CCN(CC2)c2ccc(F)cc2)c1
Show InChI InChI=1S/C19H22FN3O/c1-15-3-2-4-17(13-15)21-19(24)14-22-9-11-23(12-10-22)18-7-5-16(20)6-8-18/h2-8,13H,9-12,14H2,1H3,(H,21,24)
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Article
PubMed
90.7n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro ability to inhibit [3H]-6b binding to human Dopamine receptor D4.4


Bioorg Med Chem Lett 14: 5095-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.068
BindingDB Entry DOI: 10.7270/Q23X863Q
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50153266
PNG
(2-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-N-m-tolyl-a...)
Show SMILES Cc1cccc(NC(=O)CN2CCN(CC2)c2ccc(F)cc2)c1
Show InChI InChI=1S/C19H22FN3O/c1-15-3-2-4-17(13-15)21-19(24)14-22-9-11-23(12-10-22)18-7-5-16(20)6-8-18/h2-8,13H,9-12,14H2,1H3,(H,21,24)
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CHEMBL
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UniChem

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Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Agonist activity was calculated in calcium flux assay using HEK-293 cells co-transfected with human Dopamine receptor D4.4 and Galphaqo5


Bioorg Med Chem Lett 14: 5095-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.068
BindingDB Entry DOI: 10.7270/Q23X863Q
More data for this
Ligand-Target Pair