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BDBM50119471 1-[1,2-Bis-(4-fluoro-phenyl)-1H-imidazol-4-ylmethyl]-4-(2-ethoxy-phenyl)-piperazine::CHEMBL142147

SMILES: CCOc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1

InChI Key: InChIKey=OUQCDNRPXRIJIM-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50119471   
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 1A


(Rattus norvegicus (rat))
BDBM50119471
PNG
(1-[1,2-Bis-(4-fluoro-phenyl)-1H-imidazol-4-ylmethy...)
Show SMILES CCOc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1
Show InChI InChI=1S/C28H28F2N4O/c1-2-35-27-6-4-3-5-26(27)33-17-15-32(16-18-33)19-24-20-34(25-13-11-23(30)12-14-25)28(31-24)21-7-9-22(29)10-8-21/h3-14,20H,2,15-19H2,1H3
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 51.9n/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
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50119471
PNG
(1-[1,2-Bis-(4-fluoro-phenyl)-1H-imidazol-4-ylmethy...)
Show SMILES CCOc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1
Show InChI InChI=1S/C28H28F2N4O/c1-2-35-27-6-4-3-5-26(27)33-17-15-32(16-18-33)19-24-20-34(25-13-11-23(30)12-14-25)28(31-24)21-7-9-22(29)10-8-21/h3-14,20H,2,15-19H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 273n/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))
BDBM50119471
PNG
(1-[1,2-Bis-(4-fluoro-phenyl)-1H-imidazol-4-ylmethy...)
Show SMILES CCOc1ccccc1N1CCN(Cc2cn(c(n2)-c2ccc(F)cc2)-c2ccc(F)cc2)CC1
Show InChI InChI=1S/C28H28F2N4O/c1-2-35-27-6-4-3-5-26(27)33-17-15-32(16-18-33)19-24-20-34(25-13-11-23(30)12-14-25)28(31-24)21-7-9-22(29)10-8-21/h3-14,20H,2,15-19H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 268n/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