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Patent code US10058549

Compile Data Set for Download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
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))
BDBM269506
PNG
((4-(2-chlorophenethyl)piperazin-1- yl)(imidazo[1,2...)
Show SMILES Clc1ccccc1CCN1CCN(CC1)C(=O)c1cccn2ccnc12
Show InChI InChI=1S/C20H21ClN4O/c21-18-6-2-1-4-16(18)7-10-23-12-14-25(15-13-23)20(26)17-5-3-9-24-11-8-22-19(17)24/h1-6,8-9,11H,7,10,12-15H2
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n/an/a 4n/an/an/an/an/an/a



Arena Pharmaceuticals, Inc.

US Patent


Assay Description
Radioligand binding assays for human 5-HT2A serotonin receptor were conducted using the 5-HT2 agonist [125I]DOI as radioligand. To define nonspecific...


US Patent US10058549 (2018)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (human))
BDBM269505
PNG
((4-(2-fluoro-2-(4- fluorophenyl)ethyl)piperazin-1-...)
Show SMILES FC(CN1CCN(CC1)C(=O)c1cccn2ccnc12)c1ccc(F)cc1
Show InChI InChI=1S/C20H20F2N4O/c21-16-5-3-15(4-6-16)18(22)14-24-10-12-26(13-11-24)20(27)17-2-1-8-25-9-7-23-19(17)25/h1-9,18H,10-14H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
UniChem
n/an/a 10n/an/an/an/an/an/a



Arena Pharmaceuticals, Inc.

US Patent


Assay Description
Radioligand binding assays for human 5-HT2A serotonin receptor were conducted using the 5-HT2 agonist [125I]DOI as radioligand. To define nonspecific...


US Patent US10058549 (2018)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (human))
BDBM269504
PNG
((4-(4-fluorophenethyl)piperazin-1- yl)(2-phenylimi...)
Show SMILES Fc1ccc(CCN2CCN(CC2)C(=O)c2cccn3cc(nc23)-c2ccccc2)cc1
Show InChI InChI=1S/C26H25FN4O/c27-22-10-8-20(9-11-22)12-14-29-15-17-30(18-16-29)26(32)23-7-4-13-31-19-24(28-25(23)31)21-5-2-1-3-6-21/h1-11,13,19H,12,14-18H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
UniChem
n/an/a 46n/an/an/an/an/an/a



Arena Pharmaceuticals, Inc.

US Patent


Assay Description
Radioligand binding assays for human 5-HT2A serotonin receptor were conducted using the 5-HT2 agonist [125I]DOI as radioligand. To define nonspecific...


US Patent US10058549 (2018)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%