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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2C' and Ligand = 'BDBM50238748'   
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 2C


(Homo sapiens (Human))
BDBM50238748
PNG
(CHEMBL4098721)
Show SMILES Cl.CNC[C@H]1C[C@@H]1c1cc(F)ccc1OCC=C |r|
Show InChI InChI=1S/C14H18FNO.ClH/c1-3-6-17-14-5-4-11(15)8-13(14)12-7-10(12)9-16-2;/h3-5,8,10,12,16H,1,6-7,9H2,2H3;1H/t10-,12+;/m1./s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 13n/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Agonist activity at human 5-HT2C-INI receptor isoform expressed in Flp-IN HEK293 cells assessed as induction of Gq-mediated calcium flux measured eve...


J Med Chem 60: 6273-6288 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00584
BindingDB Entry DOI: 10.7270/Q2MK6G5C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50238748
PNG
(CHEMBL4098721)
Show SMILES Cl.CNC[C@H]1C[C@@H]1c1cc(F)ccc1OCC=C |r|
Show InChI InChI=1S/C14H18FNO.ClH/c1-3-6-17-14-5-4-11(15)8-13(14)12-7-10(12)9-16-2;/h3-5,8,10,12,16H,1,6-7,9H2,2H3;1H/t10-,12+;/m1./s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 13n/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Agonist activity at tTA containing TEV cleavage site-fused 5-HT2C-INI receptor isoform (unknown origin) expressed in TEV-fused beta-arrestin2 express...


J Med Chem 60: 6273-6288 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00584
BindingDB Entry DOI: 10.7270/Q2MK6G5C
More data for this
Ligand-Target Pair