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BDBM50238456 CHEMBL4092132

SMILES: Clc1cccc(-c2nc(cs2)C(=O)N2CCCCC2)c1Cl

InChI Key: InChIKey=SWPGMAMLXBDJQI-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50238456   
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))
BDBM50238456
PNG
(CHEMBL4092132)
Show SMILES Clc1cccc(-c2nc(cs2)C(=O)N2CCCCC2)c1Cl
Show InChI InChI=1S/C15H14Cl2N2OS/c16-11-6-4-5-10(13(11)17)14-18-12(9-21-14)15(20)19-7-2-1-3-8-19/h4-6,9H,1-3,7-8H2
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Article
PubMed
n/an/an/an/a 3.10E+3n/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Agonist activity at recombinant human 5-HT2C receptor expressed in HEK293E cells assessed as induction of intracellular Ca2+ levels after 90 secs by ...


J Med Chem 60: 6166-6190 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00385
BindingDB Entry DOI: 10.7270/Q25M680Z
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50238456
PNG
(CHEMBL4092132)
Show SMILES Clc1cccc(-c2nc(cs2)C(=O)N2CCCCC2)c1Cl
Show InChI InChI=1S/C15H14Cl2N2OS/c16-11-6-4-5-10(13(11)17)14-18-12(9-21-14)15(20)19-7-2-1-3-8-19/h4-6,9H,1-3,7-8H2
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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

Similars

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



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Agonist activity at recombinant human 5-HT2A receptor expressed in HEK293E cells assessed as induction of intracellular Ca2+ levels after 90 secs by ...


J Med Chem 60: 6166-6190 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00385
BindingDB Entry DOI: 10.7270/Q25M680Z
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50238456
PNG
(CHEMBL4092132)
Show SMILES Clc1cccc(-c2nc(cs2)C(=O)N2CCCCC2)c1Cl
Show InChI InChI=1S/C15H14Cl2N2OS/c16-11-6-4-5-10(13(11)17)14-18-12(9-21-14)15(20)19-7-2-1-3-8-19/h4-6,9H,1-3,7-8H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Agonist activity at recombinant human 5-HT2B receptor expressed in HEK293E cells assessed as induction of intracellular Ca2+ levels after 90 secs by ...


J Med Chem 60: 6166-6190 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00385
BindingDB Entry DOI: 10.7270/Q25M680Z
More data for this
Ligand-Target Pair