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BDBM50161621 (1R,S)-6-chloro-2,3,4,5-tetrahydro-1-methyl-1H-3-benzazepine::6-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine::CHEMBL362073

SMILES: CC1CNCCc2c(Cl)cccc12

InChI Key: InChIKey=HMGASYPJYKHVCW-UHFFFAOYSA-N

Data: 6 EC50

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 6 hits for monomerid = 50161621   
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 2A


(Homo sapiens (Human))
BDBM50161621
PNG
((1R,S)-6-chloro-2,3,4,5-tetrahydro-1-methyl-1H-3-b...)
Show SMILES CC1CNCCc2c(Cl)cccc12
Show InChI InChI=1S/C11H14ClN/c1-8-7-13-6-5-10-9(8)3-2-4-11(10)12/h2-4,8,13H,5-7H2,1H3
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Article
PubMed
n/an/an/an/a>5.00E+3n/an/an/an/a



Arena Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration towards 5-hydroxytryptamine 2B receptors transfected in HEK-293 cells was determined by measuring [3H]-phosphoinositol releas...


Bioorg Med Chem Lett 15: 1467-70 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.080
BindingDB Entry DOI: 10.7270/Q21R6Q0G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50161621
PNG
((1R,S)-6-chloro-2,3,4,5-tetrahydro-1-methyl-1H-3-b...)
Show SMILES CC1CNCCc2c(Cl)cccc12
Show InChI InChI=1S/C11H14ClN/c1-8-7-13-6-5-10-9(8)3-2-4-11(10)12/h2-4,8,13H,5-7H2,1H3
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Article
PubMed
n/an/an/an/a 860n/an/an/an/a



Arena Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration towards 5-hydroxytryptamine 2A receptors transfected in HEK-293 cells was determined by measuring [3H]-phosphoinositol releas...


Bioorg Med Chem Lett 15: 1467-70 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.080
BindingDB Entry DOI: 10.7270/Q21R6Q0G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50161621
PNG
((1R,S)-6-chloro-2,3,4,5-tetrahydro-1-methyl-1H-3-b...)
Show SMILES CC1CNCCc2c(Cl)cccc12
Show InChI InChI=1S/C11H14ClN/c1-8-7-13-6-5-10-9(8)3-2-4-11(10)12/h2-4,8,13H,5-7H2,1H3
Reactome pathway
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Article
PubMed
n/an/an/an/a 794n/an/an/an/a



Arena Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT2C receptor expressed in HEK293 cells assessed as intracellular IP3 accumulation


J Med Chem 51: 305-13 (2008)


Article DOI: 10.1021/jm0709034
BindingDB Entry DOI: 10.7270/Q26Q211B
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50161621
PNG
((1R,S)-6-chloro-2,3,4,5-tetrahydro-1-methyl-1H-3-b...)
Show SMILES CC1CNCCc2c(Cl)cccc12
Show InChI InChI=1S/C11H14ClN/c1-8-7-13-6-5-10-9(8)3-2-4-11(10)12/h2-4,8,13H,5-7H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

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GoogleScholar
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PC sid
UniChem

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Article
PubMed
n/an/an/an/a<1.00E+4n/an/an/an/a



Arena Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT2B receptor expressed in HEK293 cells assessed as intracellular IP3 accumulation


J Med Chem 51: 305-13 (2008)


Article DOI: 10.1021/jm0709034
BindingDB Entry DOI: 10.7270/Q26Q211B
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50161621
PNG
((1R,S)-6-chloro-2,3,4,5-tetrahydro-1-methyl-1H-3-b...)
Show SMILES CC1CNCCc2c(Cl)cccc12
Show InChI InChI=1S/C11H14ClN/c1-8-7-13-6-5-10-9(8)3-2-4-11(10)12/h2-4,8,13H,5-7H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/an/an/a<1.00E+4n/an/an/an/a



Arena Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human 5HT2A receptor expressed in HEK293 cells assessed as intracellular IP3 accumulation


J Med Chem 51: 305-13 (2008)


Article DOI: 10.1021/jm0709034
BindingDB Entry DOI: 10.7270/Q26Q211B
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50161621
PNG
((1R,S)-6-chloro-2,3,4,5-tetrahydro-1-methyl-1H-3-b...)
Show SMILES CC1CNCCc2c(Cl)cccc12
Show InChI InChI=1S/C11H14ClN/c1-8-7-13-6-5-10-9(8)3-2-4-11(10)12/h2-4,8,13H,5-7H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a>5.00E+3n/an/an/an/a



Arena Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Effective concentration towards 5-hydroxytryptamine 2C receptors transfected in HEK-293 cells was determined by measuring [3H]-phosphoinositol releas...


Bioorg Med Chem Lett 15: 1467-70 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.080
BindingDB Entry DOI: 10.7270/Q21R6Q0G
More data for this
Ligand-Target Pair