Reaction Details Report a problem with these data
Target
Protein-serine O-palmitoleoyltransferase porcupine
Ligand
BDBM50133869
Substrate
n/a
Meas. Tech.
ChEMBL_1526512 (CHEMBL3635400)
IC50
27±n/a nM
Citation
 Ho, SY; Keller, TH The use of porcupine inhibitors to target Wnt-driven cancers. Bioorg Med Chem Lett 25:5472-6 (2015) [PubMed]  Article 
Target
Name:
Protein-serine O-palmitoleoyltransferase porcupine
Synonyms:
MG61 | MG61 | PORC | PORCN | PORCN_HUMAN | PPN | Probable protein-cysteine N-palmitoyltransferase porcupine | Protein MG61 | Protein-serine O-palmitoleoyltransferase porcupine
Type:
PROTEIN
Mol. Mass.:
52337.13
Organism:
Homo sapiens (Human)
Description:
ChEMBL_103574
Residue:
461
Sequence:
MATFSRQEFFQQLLQGCLLPTAQQGLDQIWLLLAICLACRLLWRLGLPSYLKHASTVAGGFFSLYHFFQLHMVWVVLLSLLCYLVLFLCRHSSHRGVFLSVTILIYLLMGEMHMVDTVTWHKMRGAQMIVAMKAVSLGFDLDRGEVGTVPSPVEFMGYLYFVGTIVFGPWISFHSYLQAVQGRPLSCRWLQKVARSLALALLCLVLSTCVGPYLFPYFIPLNGDRLLRNKKRKARGTMVRWLRAYESAVSFHFSNYFVGFLSEATATLAGAGFTEEKDHLEWDLTVSKPLNVELPRSMVEVVTSWNLPMSYWLNNYVFKNALRLGTFSAVLVTYAASALLHGFSFHLAAVLLSLAFITYVEHVLRKRLARILSACVLSKRCPPDCSHQHRLGLGVRALNLLFGALAIFHLAYLGSLFDVDVDDTTEEQGYGMAYTVHKWSELSWASHWVTFGCWIFYRLIG
  
Inhibitor
Name:
BDBM50133869
Synonyms:
CHEMBL3633800
Type:
Small organic molecule
Emp. Form.:
C23H19FN4O3S3
Mol. Mass.:
514.615
SMILES:
COc1cc(F)ccc1-n1c(SCC(=O)Nc2nc3ccc(C)cc3s2)nc2CCSc2c1=O |(5.3,-3.94,;6.54,-3.93,;7.31,-5.26,;6.55,-6.6,;7.32,-7.93,;6.71,-9,;8.86,-7.92,;9.63,-6.59,;8.85,-5.25,;9.62,-3.92,;8.84,-2.59,;7.3,-2.61,;6.52,-1.28,;4.98,-1.29,;4.37,-2.37,;4.2,.03,;2.66,.02,;1.76,1.24,;.3,.77,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-3.45,-1.38,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;9.61,-1.23,;11.15,-1.24,;12.18,-.1,;13.57,-.7,;13.43,-2.23,;11.93,-2.57,;11.18,-3.92,;11.81,-4.98,)|
Structure:
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