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BDBM50209167 CHEMBL234291::N,N-dimethyl-4-(5-methyl-1H-indol-3-yl)cyclohex-3-enamine

SMILES: CN(C)C1CCC(=CC1)c1c[nH]c2ccc(C)cc12

InChI Key: InChIKey=QWIYTDYAAUWEKP-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50209167   
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))
BDBM50209167
PNG
(CHEMBL234291 | N,N-dimethyl-4-(5-methyl-1H-indol-3...)
Show SMILES CN(C)C1CCC(=CC1)c1c[nH]c2ccc(C)cc12
Show InChI InChI=1S/C17H22N2/c1-12-4-9-17-15(10-12)16(11-18-17)13-5-7-14(8-6-13)19(2)3/h4-5,9-11,14,18H,6-8H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 770n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from human SERT expressed in HEK293 cells


Bioorg Med Chem Lett 17: 3099-104 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.040
BindingDB Entry DOI: 10.7270/Q2QN66F8
More data for this
Ligand-Target Pair