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Target
Phosphatidylcholine:ceramide cholinephosphotransferase 2
Ligand
BDBM50282208
Substrate
n/a
Meas. Tech.
ChEMBL_1724008 (CHEMBL4139286)
IC50
16±n/a nM
Citation
 Adachi, R; Ogawa, K; Matsumoto, SI; Satou, T; Tanaka, Y; Sakamoto, J; Nakahata, T; Okamoto, R; Kamaura, M; Kawamoto, T Discovery and characterization of selective human sphingomyelin synthase 2 inhibitors. Eur J Med Chem 136:283-293 (2017) [PubMed]  Article 
Target
Name:
Phosphatidylcholine:ceramide cholinephosphotransferase 2
Synonyms:
SGMS2 | SMS2 | SMS2_HUMAN | Sphingomyelin synthase 2
Type:
PROTEIN
Mol. Mass.:
42294.80
Organism:
Homo sapiens (Human)
Description:
ChEMBL_108027
Residue:
365
Sequence:
MDIIETAKLEEHLENQPSDPTNTYARPAEPVEEENKNGNGKPKSLSSGLRKGTKKYPDYIQIAMPTESRNKFPLEWWKTGIAFIYAVFNLVLTTVMITVVHERVPPKELSPPLPDKFFDYIDRVKWAFSVSEINGIILVGLWITQWLFLRYKSIVGRRFCFIIGTLYLYRCITMYVTTLPVPGMHFQCAPKLNGDSQAKVQRILRLISGGGLSITGSHILCGDFLFSGHTVTLTLTYLFIKEYSPRHFWWYHLICWLLSAAGIICILVAHEHYTIDVIIAYYITTRLFWWYHSMANEKNLKVSSQTNFLSRAWWFPIFYFFEKNVQGSIPCCFSWPLSWPPGCFKSSCKKYSRVQKIGEDNEKST
  
Inhibitor
Name:
BDBM50282208
Synonyms:
CHEMBL4177314
Type:
Small organic molecule
Emp. Form.:
C33H25F6N3O3
Mol. Mass.:
625.5603
SMILES:
CN(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(=O)c1c(OCc2ccnc(c2)-c2ccccc2)c2ccccc2n(C)c1=O
Structure:
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