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BDBM50403968 CHEMBL310940

SMILES: CN1CCN(CC2CC3N(O2)c2ccccc2Cc2ccccc32)CC1

InChI Key: InChIKey=BELFTABQPVPWDW-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50403968   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50403968
PNG
(CHEMBL310940)
Show SMILES CN1CCN(CC2CC3N(O2)c2ccccc2Cc2ccccc32)CC1
Show InChI InChI=1S/C22H27N3O/c1-23-10-12-24(13-11-23)16-19-15-22-20-8-4-2-6-17(20)14-18-7-3-5-9-21(18)25(22)26-19/h2-9,19,22H,10-16H2,1H3
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PC cid
PC sid
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Similars

PubMed
n/an/a<1.00E+3n/an/an/an/an/an/a



Janssen-Cilag

Curated by ChEMBL


Assay Description
Binding affinity for human cloned 5-hydroxytryptamine 2C receptor expressed in CHO cells using [3H]mesulergine as radioligand


Bioorg Med Chem Lett 12: 243-8 (2001)


BindingDB Entry DOI: 10.7270/Q23J3F4C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50403968
PNG
(CHEMBL310940)
Show SMILES CN1CCN(CC2CC3N(O2)c2ccccc2Cc2ccccc32)CC1
Show InChI InChI=1S/C22H27N3O/c1-23-10-12-24(13-11-23)16-19-15-22-20-8-4-2-6-17(20)14-18-7-3-5-9-21(18)25(22)26-19/h2-9,19,22H,10-16H2,1H3
PDB
MMDB

Reactome pathway
KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 282n/an/an/an/an/an/a



Janssen-Cilag

Curated by ChEMBL


Assay Description
Binding affinity for human cloned 5-hydroxytryptamine 2A receptor expressed in L929 cells using [125I]R91150 as radioligand


Bioorg Med Chem Lett 12: 243-8 (2001)


BindingDB Entry DOI: 10.7270/Q23J3F4C
More data for this
Ligand-Target Pair