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BDBM50238767 CHEMBL4102683

SMILES: Cl.COc1ccc(F)cc1C1CC1CNCc1ccccc1O

InChI Key: InChIKey=OBNPFXVCHZECQQ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50238767   
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))
BDBM50238767
PNG
(CHEMBL4102683)
Show SMILES Cl.COc1ccc(F)cc1C1CC1CNCc1ccccc1O
Show InChI InChI=1S/C18H20FNO2.ClH/c1-22-18-7-6-14(19)9-16(18)15-8-13(15)11-20-10-12-4-2-3-5-17(12)21;/h2-7,9,13,15,20-21H,8,10-11H2,1H3;1H
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Article
PubMed
n/an/an/an/a 78n/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Agonist activity at human 5-HT2A receptor expressed in Flp-IN HEK293 cells assessed as induction of calcium flux measured every second for 5 mins by ...


J Med Chem 60: 6273-6288 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00584
BindingDB Entry DOI: 10.7270/Q2MK6G5C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50238767
PNG
(CHEMBL4102683)
Show SMILES Cl.COc1ccc(F)cc1C1CC1CNCc1ccccc1O
Show InChI InChI=1S/C18H20FNO2.ClH/c1-22-18-7-6-14(19)9-16(18)15-8-13(15)11-20-10-12-4-2-3-5-17(12)21;/h2-7,9,13,15,20-21H,8,10-11H2,1H3;1H
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 77n/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Agonist activity at human 5-HT2A receptor expressed in Flp-IN HEK293 cells assessed as induction of calcium flux measured every second for 5 mins by ...


J Med Chem 60: 6273-6288 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00584
BindingDB Entry DOI: 10.7270/Q2MK6G5C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50238767
PNG
(CHEMBL4102683)
Show SMILES Cl.COc1ccc(F)cc1C1CC1CNCc1ccccc1O
Show InChI InChI=1S/C18H20FNO2.ClH/c1-22-18-7-6-14(19)9-16(18)15-8-13(15)11-20-10-12-4-2-3-5-17(12)21;/h2-7,9,13,15,20-21H,8,10-11H2,1H3;1H
Reactome pathway
KEGG

UniProtKB/SwissProt

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GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


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Article
PubMed
n/an/an/an/a 302n/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Agonist activity at human 5-HT2C-INI receptor isoform expressed in Flp-IN HEK293 cells assessed as induction of Gq-mediated calcium flux measured eve...


J Med Chem 60: 6273-6288 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00584
BindingDB Entry DOI: 10.7270/Q2MK6G5C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50238767
PNG
(CHEMBL4102683)
Show SMILES Cl.COc1ccc(F)cc1C1CC1CNCc1ccccc1O
Show InChI InChI=1S/C18H20FNO2.ClH/c1-22-18-7-6-14(19)9-16(18)15-8-13(15)11-20-10-12-4-2-3-5-17(12)21;/h2-7,9,13,15,20-21H,8,10-11H2,1H3;1H
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 304n/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Agonist activity at human 5-HT2C-INI receptor isoform expressed in Flp-IN HEK293 cells assessed as induction of Gq-mediated calcium flux measured eve...


J Med Chem 60: 6273-6288 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00584
BindingDB Entry DOI: 10.7270/Q2MK6G5C
More data for this
Ligand-Target Pair