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SMILES: O=c1c(-c2ccccc2)c2CCCCn2c(=O)n1CCCCN1CCC(CC1)c1c[nH]c2ccccc12

InChI Key: InChIKey=ZWCDVHYLXFGFIT-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50335618   
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))
BDBM50335618
PNG
(2-{4-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-y...)
Show SMILES O=c1c(-c2ccccc2)c2CCCCn2c(=O)n1CCCCN1CCC(CC1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C31H36N4O2/c36-30-29(24-10-2-1-3-11-24)28-14-6-7-18-34(28)31(37)35(30)19-9-8-17-33-20-15-23(16-21-33)26-22-32-27-13-5-4-12-25(26)27/h1-5,10-13,22-23,32H,6-9,14-21H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
28.3n/an/an/an/an/an/an/an/a



Medical University of Warsaw

Curated by ChEMBL


Assay Description
Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus


Eur J Med Chem 46: 142-9 (2010)


Article DOI: 10.1016/j.ejmech.2010.10.026
BindingDB Entry DOI: 10.7270/Q2251JFS
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50335618
PNG
(2-{4-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-y...)
Show SMILES O=c1c(-c2ccccc2)c2CCCCn2c(=O)n1CCCCN1CCC(CC1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C31H36N4O2/c36-30-29(24-10-2-1-3-11-24)28-14-6-7-18-34(28)31(37)35(30)19-9-8-17-33-20-15-23(16-21-33)26-22-32-27-13-5-4-12-25(26)27/h1-5,10-13,22-23,32H,6-9,14-21H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
81.7n/an/an/an/an/an/an/an/a



Medical University of Warsaw

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting


Eur J Med Chem 46: 142-9 (2010)


Article DOI: 10.1016/j.ejmech.2010.10.026
BindingDB Entry DOI: 10.7270/Q2251JFS
More data for this
Ligand-Target Pair