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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2A' and Ligand = 'BDBM50477630'   
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 2A


(Homo sapiens (Human))
BDBM50477630
PNG
(CHEMBL391985 | QF-4218B)
Show SMILES Cc1noc2CC(CN3CCC(CC3)c3noc4cc(F)ccc34)CC(=O)c12
Show InChI InChI=1S/C21H22FN3O3/c1-12-20-17(26)8-13(9-19(20)28-23-12)11-25-6-4-14(5-7-25)21-16-3-2-15(22)10-18(16)27-24-21/h2-3,10,13-14H,4-9,11H2,1H3
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PC cid
PC sid
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Article
PubMed
17n/an/an/an/an/an/an/an/a



Universidad de Santiago de Compostela

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin human cloned serotonin 5HT2A receptor


Bioorg Med Chem Lett 17: 4873-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.045
BindingDB Entry DOI: 10.7270/Q2J38WCB
More data for this
Ligand-Target Pair