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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 410.4
BDBM50437411

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Probable G-protein coupled receptor 142


(Homo sapiens (Human))
BDBM50437411
PNG
(CHEMBL2409022)
Show SMILES CCOCc1c(cnn1-c1ncc(C)c(n1)N1CCC1)C(=O)NCc1cncn1C
Show InChI InChI=1S/C20H26N8O2/c1-4-30-12-17-16(19(29)22-10-15-9-21-13-26(15)3)11-24-28(17)20-23-8-14(2)18(25-20)27-6-5-7-27/h8-9,11,13H,4-7,10,12H2,1-3H3,(H,22,29)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 28n/an/an/an/a



Daiichi Sankyo Co., Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human GPR142 transfected in HEK293 cells after 1 hr by inositol phosphate accumulation assay


ACS Med Chem Lett 4: 790-4 (2013)


Article DOI: 10.1021/ml400186z
BindingDB Entry DOI: 10.7270/Q24J0GHW
More data for this
Ligand-Target Pair