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BDBM50434591 CHEMBL2386615

SMILES: COc1ccccc1N1CCCN(CCCCNC(=O)c2ccc(s2)-c2ccccc2)CC1

InChI Key: InChIKey=FHXDBZHSFZNQBN-UHFFFAOYSA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50434591   
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))
BDBM50434591
PNG
(CHEMBL2386615)
Show SMILES COc1ccccc1N1CCCN(CCCCNC(=O)c2ccc(s2)-c2ccccc2)CC1
Show InChI InChI=1S/C27H33N3O2S/c1-32-24-13-6-5-12-23(24)30-19-9-18-29(20-21-30)17-8-7-16-28-27(31)26-15-14-25(33-26)22-10-3-2-4-11-22/h2-6,10-15H,7-9,16-21H2,1H3,(H,28,31)
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PC cid
PC sid
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Similars

Article
PubMed
107n/an/an/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Displacement of [125I]ABN from human dopamine D2L receptor expressed in HEK293 cells after 60 mins by gamma counting analysis


Bioorg Med Chem 21: 2988-98 (2013)


Article DOI: 10.1016/j.bmc.2013.03.074
BindingDB Entry DOI: 10.7270/Q2697509
More data for this
Ligand-Target Pair