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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 431.4
BDBM50205397

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
Protein-serine O-palmitoleoyltransferase porcupine


(Mus musculus)
BDBM50205397
PNG
(CHEMBL3961192)
Show SMILES O=C(Cn1nnc(c1-c1ccccc1)-c1ccncc1)Nc1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C27H21N5O/c33-25(29-24-13-7-12-23(18-24)20-8-3-1-4-9-20)19-32-27(22-10-5-2-6-11-22)26(30-31-32)21-14-16-28-17-15-21/h1-18H,19H2,(H,29,33)
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PC sid
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Similars

Article
PubMed
n/an/an/an/a 270n/an/an/an/a



UT Southwestern Medical Center

Curated by ChEMBL


Assay Description
Inhibition of porcupine-mediated Wnt signaling in mouse L-cells after 24 hrs by springerImage-Topflash reporter assay


Bioorg Med Chem Lett 26: 5891-5895 (2016)


Article DOI: 10.1016/j.bmcl.2016.11.012
BindingDB Entry DOI: 10.7270/Q2959KJR
More data for this
Ligand-Target Pair