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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 3A' and Ligand = 'BDBM50365245'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM50365245
PNG
(CHEMBL1958132)
Show SMILES O=c1cc(cn[nH]1)-c1ccc(OCCCN2CCCCC2)cc1
Show InChI InChI=1S/C18H23N3O2/c22-18-13-16(14-19-20-18)15-5-7-17(8-6-15)23-12-4-11-21-9-2-1-3-10-21/h5-8,13-14H,1-4,9-12H2,(H,20,22)
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PC cid
PC sid
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Article
PubMed
19n/an/an/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]NAMH from human cloned 5HT3 receptor expressed in CHO cells


J Med Chem 55: 414-23 (2012)


Article DOI: 10.1021/jm201295j
BindingDB Entry DOI: 10.7270/Q2S46SFR
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(RAT)
BDBM50365245
PNG
(CHEMBL1958132)
Show SMILES O=c1cc(cn[nH]1)-c1ccc(OCCCN2CCCCC2)cc1
Show InChI InChI=1S/C18H23N3O2/c22-18-13-16(14-19-20-18)15-5-7-17(8-6-15)23-12-4-11-21-9-2-1-3-10-21/h5-8,13-14H,1-4,9-12H2,(H,20,22)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
28n/an/an/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]NAMH from rat cloned 5HT3 receptor expressed in CHO cells


J Med Chem 55: 414-23 (2012)


Article DOI: 10.1021/jm201295j
BindingDB Entry DOI: 10.7270/Q2S46SFR
More data for this
Ligand-Target Pair