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SMILES: O=C(N1CCOCC1)c1nc(cs1)-c1cccc2ccccc12

InChI Key: InChIKey=NCLXAJFGEKRKSS-UHFFFAOYSA-N

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 = 50238524   
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))
BDBM50238524
PNG
(CHEMBL4078330)
Show SMILES O=C(N1CCOCC1)c1nc(cs1)-c1cccc2ccccc12
Show InChI InChI=1S/C18H16N2O2S/c21-18(20-8-10-22-11-9-20)17-19-16(12-23-17)15-7-3-5-13-4-1-2-6-14(13)15/h1-7,12H,8-11H2
PDB
MMDB

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PC cid
PC sid
UniChem
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))
BDBM50238524
PNG
(CHEMBL4078330)
Show SMILES O=C(N1CCOCC1)c1nc(cs1)-c1cccc2ccccc12
Show InChI InChI=1S/C18H16N2O2S/c21-18(20-8-10-22-11-9-20)17-19-16(12-23-17)15-7-3-5-13-4-1-2-6-14(13)15/h1-7,12H,8-11H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
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
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50238524
PNG
(CHEMBL4078330)
Show SMILES O=C(N1CCOCC1)c1nc(cs1)-c1cccc2ccccc12
Show InChI InChI=1S/C18H16N2O2S/c21-18(20-8-10-22-11-9-20)17-19-16(12-23-17)15-7-3-5-13-4-1-2-6-14(13)15/h1-7,12H,8-11H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 729n/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