Reaction Details Report a problem with these data
Target
Phosphatidylcholine:ceramide cholinephosphotransferase 2
Ligand
BDBM50446999
Substrate
n/a
Meas. Tech.
ChEMBL_1289164 (CHEMBL3119037)
IC50
35000±n/a nM
Citation
 Deng, X; Lin, F; Zhang, Y; Li, Y; Zhou, L; Lou, B; Li, Y; Dong, J; Ding, T; Jiang, X; Wang, R; Ye, D Identification of small molecule sphingomyelin synthase inhibitors. Eur J Med Chem 73:1-7 (2014) [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:
BDBM50446999
Synonyms:
CHEMBL3116247
Type:
Small organic molecule
Emp. Form.:
C20H17N3O
Mol. Mass.:
315.3685
SMILES:
N#CC(Nc1cccnc1)c1ccccc1OCc1ccccc1
Structure:
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