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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2B' and Ligand = 'BDBM50161638'   
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 2B


(Homo sapiens (Human))
BDBM50161638
PNG
((1R,S)-8-chloro-7-methoxy-2,3,4,5-tetrahydro-1-met...)
Show SMILES COc1cc2CCNCC(C)c2cc1Cl
Show InChI InChI=1S/C12H16ClNO/c1-8-7-14-4-3-9-5-12(15-2)11(13)6-10(8)9/h5-6,8,14H,3-4,7H2,1-2H3
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PC sid
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Article
PubMed
n/an/an/an/a 63n/an/an/an/a



Arena Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT2B receptor expressed in HEK293 cells assessed as intracellular IP3 accumulation


J Med Chem 51: 305-13 (2008)


Article DOI: 10.1021/jm0709034
BindingDB Entry DOI: 10.7270/Q26Q211B
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50161638
PNG
((1R,S)-8-chloro-7-methoxy-2,3,4,5-tetrahydro-1-met...)
Show SMILES COc1cc2CCNCC(C)c2cc1Cl
Show InChI InChI=1S/C12H16ClNO/c1-8-7-14-4-3-9-5-12(15-2)11(13)6-10(8)9/h5-6,8,14H,3-4,7H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 140n/an/an/an/a



Arena Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration towards 5-hydroxytryptamine 2C receptors transfected in HEK-293 cells was determined by measuring [3H]-phosphoinositol releas...


Bioorg Med Chem Lett 15: 1467-70 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.080
BindingDB Entry DOI: 10.7270/Q21R6Q0G
More data for this
Ligand-Target Pair