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SMILES: FC(F)(F)c1ccc(OC(CCN2CCN(CC2)c2ccccn2)c2ccccc2)cc1

InChI Key: InChIKey=BFUZKYZYAVZLHQ-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50102368   
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
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50102368
PNG
(1-(3-phenyl-3-(4-(trifluoromethyl)phenoxy)propyl)-...)
Show SMILES FC(F)(F)c1ccc(OC(CCN2CCN(CC2)c2ccccn2)c2ccccc2)cc1
Show InChI InChI=1S/C25H26F3N3O/c26-25(27,28)21-9-11-22(12-10-21)32-23(20-6-2-1-3-7-20)13-15-30-16-18-31(19-17-30)24-8-4-5-14-29-24/h1-12,14,23H,13,15-19H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
1.50E+3n/an/an/an/an/an/an/an/a



Universidad de Navarra

Curated by ChEMBL


Assay Description
Binding affinity towards Serotonin transporter from rat cortex measured using [3H]-paroxetine


J Med Chem 44: 418-28 (2001)


BindingDB Entry DOI: 10.7270/Q22B8XBC
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50102368
PNG
(1-(3-phenyl-3-(4-(trifluoromethyl)phenoxy)propyl)-...)
Show SMILES FC(F)(F)c1ccc(OC(CCN2CCN(CC2)c2ccccn2)c2ccccc2)cc1
Show InChI InChI=1S/C25H26F3N3O/c26-25(27,28)21-9-11-22(12-10-21)32-23(20-6-2-1-3-7-20)13-15-30-16-18-31(19-17-30)24-8-4-5-14-29-24/h1-12,14,23H,13,15-19H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.58E+3n/an/an/an/an/an/an/an/a



Universidade Federal da Para£ba

Curated by ChEMBL


Assay Description
Antagonist activity at 5HT1A


Eur J Med Chem 45: 1508-14 (2010)


Article DOI: 10.1016/j.ejmech.2009.12.059
BindingDB Entry DOI: 10.7270/Q2HX1DX1
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50102368
PNG
(1-(3-phenyl-3-(4-(trifluoromethyl)phenoxy)propyl)-...)
Show SMILES FC(F)(F)c1ccc(OC(CCN2CCN(CC2)c2ccccn2)c2ccccc2)cc1
Show InChI InChI=1S/C25H26F3N3O/c26-25(27,28)21-9-11-22(12-10-21)32-23(20-6-2-1-3-7-20)13-15-30-16-18-31(19-17-30)24-8-4-5-14-29-24/h1-12,14,23H,13,15-19H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.58E+3n/an/an/an/an/an/an/an/a



Universidade de S£o Paulo

Curated by ChEMBL


Assay Description
Binding affinity to 5HT1A receptor


Eur J Med Chem 43: 364-72 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.036
BindingDB Entry DOI: 10.7270/Q2SQ91NB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50102368
PNG
(1-(3-phenyl-3-(4-(trifluoromethyl)phenoxy)propyl)-...)
Show SMILES FC(F)(F)c1ccc(OC(CCN2CCN(CC2)c2ccccn2)c2ccccc2)cc1
Show InChI InChI=1S/C25H26F3N3O/c26-25(27,28)21-9-11-22(12-10-21)32-23(20-6-2-1-3-7-20)13-15-30-16-18-31(19-17-30)24-8-4-5-14-29-24/h1-12,14,23H,13,15-19H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
1.60E+3n/an/an/an/an/an/an/an/a



Universidad de Navarra

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 1A receptor (5-HT 1A receptor, serotonin receptor) from rat cortex using [3H]-8-OH-DPAT as radioligand


J Med Chem 44: 418-28 (2001)


BindingDB Entry DOI: 10.7270/Q22B8XBC
More data for this
Ligand-Target Pair