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SMILES: FC(F)(F)c1cccc(COc2ccc(Br)cc2OC2CNC2)c1

InChI Key: InChIKey=CWAYESQBOZBJAS-UHFFFAOYSA-N

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 2 hits for monomerid = 396383   
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


(Homo sapiens (Human))
BDBM396383
PNG
(3-[5-Bromo-2-(3-trifluoromethyl-benzyloxy)-phenoxy...)
Show SMILES FC(F)(F)c1cccc(COc2ccc(Br)cc2OC2CNC2)c1
Show InChI InChI=1S/C17H15BrF3NO2/c18-13-4-5-15(16(7-13)24-14-8-22-9-14)23-10-11-2-1-3-12(6-11)17(19,20)21/h1-7,14,22H,8-10H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
4n/an/an/an/an/an/an/an/a



Novartis



Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


J Med Chem 52: 3523-38 (2009)


BindingDB Entry DOI: 10.7270/Q26T0Q0F
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Rattus norvegicus (rat))
BDBM396383
PNG
(3-[5-Bromo-2-(3-trifluoromethyl-benzyloxy)-phenoxy...)
Show SMILES FC(F)(F)c1cccc(COc2ccc(Br)cc2OC2CNC2)c1
Show InChI InChI=1S/C17H15BrF3NO2/c18-13-4-5-15(16(7-13)24-14-8-22-9-14)23-10-11-2-1-3-12(6-11)17(19,20)21/h1-7,14,22H,8-10H2
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
6n/an/an/an/an/an/an/an/a



Novartis



Assay Description
Receptor binding was performed using membrane fractions prepared from the HEK-293 cell line recombinantly expressing rat 5-HT7 receptors (NCBI access...


J Med Chem 52: 3523-38 (2009)


BindingDB Entry DOI: 10.7270/Q26T0Q0F
More data for this
Ligand-Target Pair