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BDBM50119472 1-[1,2-Bis-(4-fluoro-phenyl)-1H-imidazol-4-ylmethyl]-4-(2-methoxy-phenyl)-piperazine::CHEMBL143372

SMILES: COc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1

InChI Key: InChIKey=YKZBAGIEZBPODW-UHFFFAOYSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50119472   
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
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50119472
PNG
(1-[1,2-Bis-(4-fluoro-phenyl)-1H-imidazol-4-ylmethy...)
Show SMILES COc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1
Show InChI InChI=1S/C27H26F2N4O/c1-34-26-5-3-2-4-25(26)32-16-14-31(15-17-32)18-23-19-33(24-12-10-22(29)11-13-24)27(30-23)20-6-8-21(28)9-7-20/h2-13,19H,14-18H2,1H3
PDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 259n/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
In vitro binding affinity for serotonin 5-hydroxytryptamine 2A receptor of rat cerebral cortex using [3H]ketanserin as radioligand


J Med Chem 45: 4655-68 (2002)


BindingDB Entry DOI: 10.7270/Q21G0N0M
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50119472
PNG
(1-[1,2-Bis-(4-fluoro-phenyl)-1H-imidazol-4-ylmethy...)
Show SMILES COc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1
Show InChI InChI=1S/C27H26F2N4O/c1-34-26-5-3-2-4-25(26)32-16-14-31(15-17-32)18-23-19-33(24-12-10-22(29)11-13-24)27(30-23)20-6-8-21(28)9-7-20/h2-13,19H,14-18H2,1H3
PDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 120n/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
In vitro binding affinity for Dopamine D2 receptor of rat using [3H]YM-09151 as radioligand


J Med Chem 45: 4655-68 (2002)


BindingDB Entry DOI: 10.7270/Q21G0N0M
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50119472
PNG
(1-[1,2-Bis-(4-fluoro-phenyl)-1H-imidazol-4-ylmethy...)
Show SMILES COc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1
Show InChI InChI=1S/C27H26F2N4O/c1-34-26-5-3-2-4-25(26)32-16-14-31(15-17-32)18-23-19-33(24-12-10-22(29)11-13-24)27(30-23)20-6-8-21(28)9-7-20/h2-13,19H,14-18H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 171n/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
In vitro binding affinity for serotonin 5-hydroxytryptamine 1A receptor fof rat cerebral cortex using [3H]8-OH-DPAT as radioligand


J Med Chem 45: 4655-68 (2002)


BindingDB Entry DOI: 10.7270/Q21G0N0M
More data for this
Ligand-Target Pair