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BDBM50070896 CHEMBL3409234

SMILES: O=C1CCc2ccc(OCCCCN3CCC(CC3)c3cn(Cc4ccccc4)c4ccccc34)cc2N1

InChI Key: InChIKey=BDRBUIOJOVVPMF-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50070896   
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
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50070896
PNG
(CHEMBL3409234)
Show SMILES O=C1CCc2ccc(OCCCCN3CCC(CC3)c3cn(Cc4ccccc4)c4ccccc34)cc2N1
Show InChI InChI=1S/C33H37N3O2/c37-33-15-13-27-12-14-28(22-31(27)34-33)38-21-7-6-18-35-19-16-26(17-20-35)30-24-36(23-25-8-2-1-3-9-25)32-11-5-4-10-29(30)32/h1-5,8-12,14,22,24,26H,6-7,13,15-21,23H2,(H,34,37)
PDB

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PC cid
PC sid
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Similars

Article
PubMed
4.80n/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
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50070896
PNG
(CHEMBL3409234)
Show SMILES O=C1CCc2ccc(OCCCCN3CCC(CC3)c3cn(Cc4ccccc4)c4ccccc34)cc2N1
Show InChI InChI=1S/C33H37N3O2/c37-33-15-13-27-12-14-28(22-31(27)34-33)38-21-7-6-18-35-19-16-26(17-20-35)30-24-36(23-25-8-2-1-3-9-25)32-11-5-4-10-29(30)32/h1-5,8-12,14,22,24,26H,6-7,13,15-21,23H2,(H,34,37)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
150n/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