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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 = 'BDBM50099278'   
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))
BDBM50099278
PNG
(3-(2-Phenyl-1H-indol-3-yl)-piperidin-4-ol | CHEMBL...)
Show SMILES O[C@@H]1CCNCC1c1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C19H20N2O/c22-17-10-11-20-12-15(17)18-14-8-4-5-9-16(14)21-19(18)13-6-2-1-3-7-13/h1-9,15,17,20-22H,10-12H2/t15?,17-/m1/s1
PDB
MMDB

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PC cid
PC sid
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Similars

PubMed
3.30n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme

Curated by ChEMBL


Assay Description
Ability to displace [3H]-ketanserin binding to human 5-hydroxytryptamine 2A receptor stably expressed in CHO cells


J Med Chem 44: 1603-14 (2001)


BindingDB Entry DOI: 10.7270/Q27M076K
More data for this
Ligand-Target Pair