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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 = 'BDBM50091832'   
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))
BDBM50091832
PNG
(7,9-Dichloro-2,3,4,4a-tetrahydro-1H,6H-pyrazino[1,...)
Show SMILES Clc1cc(Cl)c2NC(=O)C3CNCCN3c2c1
Show InChI InChI=1S/C11H11Cl2N3O/c12-6-3-7(13)10-8(4-6)16-2-1-14-5-9(16)11(17)15-10/h3-4,9,14H,1-2,5H2,(H,15,17)
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PC cid
PC sid
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Similars

PubMed
20n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Agonistic activity for 5-HT2c (5-HT2C) by measuring [3H]-inositol monophosphate fromation in CHO cells in which the human 5-HT2C receptor subtype was...


Bioorg Med Chem Lett 10: 1991-4 (2001)


BindingDB Entry DOI: 10.7270/Q2Z89BMP
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50091832
PNG
(7,9-Dichloro-2,3,4,4a-tetrahydro-1H,6H-pyrazino[1,...)
Show SMILES Clc1cc(Cl)c2NC(=O)C3CNCCN3c2c1
Show InChI InChI=1S/C11H11Cl2N3O/c12-6-3-7(13)10-8(4-6)16-2-1-14-5-9(16)11(17)15-10/h3-4,9,14H,1-2,5H2,(H,15,17)
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
368n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Binding affinity using [3H]-mesulergine as radioligand with receptor membranes isolated from a CHO-k cell line expressing the human 5-hydroxytryptami...


Bioorg Med Chem Lett 10: 1991-4 (2001)


BindingDB Entry DOI: 10.7270/Q2Z89BMP
More data for this
Ligand-Target Pair