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BDBM50393385 CHEMBL2159479

SMILES: Fc1ccc(cc1)S(=O)(=O)NC1CCN(CCOc2ccccc2)C1

InChI Key: InChIKey=LHMHWJFZTBPLDP-UHFFFAOYSA-N

Data: 4 KI

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 = 50393385   
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 1A


(Homo sapiens (Human))
BDBM50393385
PNG
(CHEMBL2159479)
Show SMILES Fc1ccc(cc1)S(=O)(=O)NC1CCN(CCOc2ccccc2)C1
Show InChI InChI=1S/C18H21FN2O3S/c19-15-6-8-18(9-7-15)25(22,23)20-16-10-11-21(14-16)12-13-24-17-4-2-1-3-5-17/h1-9,16,20H,10-14H2
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PC sid
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Article
PubMed
9n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in HEK293 cells after 1 hr


Eur J Med Chem 56: 348-360 (2012)


Article DOI: 10.1016/j.ejmech.2012.07.043
BindingDB Entry DOI: 10.7270/Q28P61N6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50393385
PNG
(CHEMBL2159479)
Show SMILES Fc1ccc(cc1)S(=O)(=O)NC1CCN(CCOc2ccccc2)C1
Show InChI InChI=1S/C18H21FN2O3S/c19-15-6-8-18(9-7-15)25(22,23)20-16-10-11-21(14-16)12-13-24-17-4-2-1-3-5-17/h1-9,16,20H,10-14H2
Reactome pathway
KEGG

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antibodypedia
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PC sid
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Article
PubMed
9n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-5-CT from human 5-HT7b receptor expressed in HEK293 cells after 1 hr


Eur J Med Chem 56: 348-360 (2012)


Article DOI: 10.1016/j.ejmech.2012.07.043
BindingDB Entry DOI: 10.7270/Q28P61N6
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50393385
PNG
(CHEMBL2159479)
Show SMILES Fc1ccc(cc1)S(=O)(=O)NC1CCN(CCOc2ccccc2)C1
Show InChI InChI=1S/C18H21FN2O3S/c19-15-6-8-18(9-7-15)25(22,23)20-16-10-11-21(14-16)12-13-24-17-4-2-1-3-5-17/h1-9,16,20H,10-14H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
11n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity to human dopamine D2L receptor expressed in HEK293 cells after 1 hr


Eur J Med Chem 56: 348-360 (2012)


Article DOI: 10.1016/j.ejmech.2012.07.043
BindingDB Entry DOI: 10.7270/Q28P61N6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50393385
PNG
(CHEMBL2159479)
Show SMILES Fc1ccc(cc1)S(=O)(=O)NC1CCN(CCOc2ccccc2)C1
Show InChI InChI=1S/C18H21FN2O3S/c19-15-6-8-18(9-7-15)25(22,23)20-16-10-11-21(14-16)12-13-24-17-4-2-1-3-5-17/h1-9,16,20H,10-14H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
248n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6 receptor expressed in HEK293 cells after 1 hr


Eur J Med Chem 56: 348-360 (2012)


Article DOI: 10.1016/j.ejmech.2012.07.043
BindingDB Entry DOI: 10.7270/Q28P61N6
More data for this
Ligand-Target Pair