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Compile Data Set for Download or QSAR

Found 3 hits of ki for monomerid = 50108710   
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


(Rattus norvegicus (rat))
BDBM50108710
PNG
(4-(4-Benzenesulfonyl-piperidin-1-yl)-1-(4-fluoro-p...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C21H24FNO3S/c22-18-10-8-17(9-11-18)21(24)7-4-14-23-15-12-20(13-16-23)27(25,26)19-5-2-1-3-6-19/h1-3,5-6,8-11,20H,4,7,12-16H2
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PC cid
PC sid
UniChem
PubMed
3.30n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme

Curated by ChEMBL


Assay Description
Binding affinity for displacement of [3H]ketanserin to rat 5-hydroxytryptamine 2A receptor stably expressed in CHO cells


J Med Chem 45: 492-503 (2002)


BindingDB Entry DOI: 10.7270/Q2KH0P27
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50108710
PNG
(4-(4-Benzenesulfonyl-piperidin-1-yl)-1-(4-fluoro-p...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C21H24FNO3S/c22-18-10-8-17(9-11-18)21(24)7-4-14-23-15-12-20(13-16-23)27(25,26)19-5-2-1-3-6-19/h1-3,5-6,8-11,20H,4,7,12-16H2
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PC cid
PC sid
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15n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme

Curated by ChEMBL


Assay Description
Binding affinity for displacement of [3H]ketanserin to human 5-hydroxytryptamine 2A receptor stably expressed in CHO cells


J Med Chem 45: 492-503 (2002)


BindingDB Entry DOI: 10.7270/Q2KH0P27
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50108710
PNG
(4-(4-Benzenesulfonyl-piperidin-1-yl)-1-(4-fluoro-p...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C21H24FNO3S/c22-18-10-8-17(9-11-18)21(24)7-4-14-23-15-12-20(13-16-23)27(25,26)19-5-2-1-3-6-19/h1-3,5-6,8-11,20H,4,7,12-16H2
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1.10E+3n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme

Curated by ChEMBL


Assay Description
Binding affinity for displacement of [3H]spiperone to human dopamine D2 (hD2) receptors stably expressed in CHO cells


J Med Chem 45: 492-503 (2002)


BindingDB Entry DOI: 10.7270/Q2KH0P27
More data for this
Ligand-Target Pair