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BDBM50070812 CHEMBL3409248

SMILES: NC(=O)c1ccccc1OCCCNCCc1cn(c2ccccc12)S(=O)(=O)c1ccccc1

InChI Key: InChIKey=STHXBYBOTUFDBJ-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50070812   
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 6


(Homo sapiens (Human))
BDBM50070812
PNG
(CHEMBL3409248)
Show SMILES NC(=O)c1ccccc1OCCCNCCc1cn(c2ccccc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C26H27N3O4S/c27-26(30)23-12-5-7-14-25(23)33-18-8-16-28-17-15-20-19-29(24-13-6-4-11-22(20)24)34(31,32)21-9-2-1-3-10-21/h1-7,9-14,19,28H,8,15-18H2,(H2,27,30)
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PC cid
PC sid
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Similars

Article
PubMed
62n/an/an/an/an/an/an/an/a



Jagiellonian University Collegium Medicum

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human recombinant 5-HT6 receptor expressed in HEK-293 cells incubated for 60 mins by scintillation counting method


Eur J Med Chem 92: 221-35 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.045
BindingDB Entry DOI: 10.7270/Q2Q241XV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50070812
PNG
(CHEMBL3409248)
Show SMILES NC(=O)c1ccccc1OCCCNCCc1cn(c2ccccc12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C26H27N3O4S/c27-26(30)23-12-5-7-14-25(23)33-18-8-16-28-17-15-20-19-29(24-13-6-4-11-22(20)24)34(31,32)21-9-2-1-3-10-21/h1-7,9-14,19,28H,8,15-18H2,(H2,27,30)
PDB

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GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
180n/an/an/an/an/an/an/an/a



Jagiellonian University Collegium Medicum

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from human recombinant dopamine D2 receptor expressed in CHOK1 cells incubated for 60 mins by scintillation cou...


Eur J Med Chem 92: 221-35 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.045
BindingDB Entry DOI: 10.7270/Q2Q241XV
More data for this
Ligand-Target Pair