Reaction Details Report a problem with these data
Target
Sphingomyelin phosphodiesterase 3
Ligand
BDBM29040
Substrate
n/a
Meas. Tech.
ChEMBL_2266743
IC50
6000±n/a nM
Citation
 Skácel, J; Slusher, BS; Tsukamoto, T Small Molecule Inhibitors Targeting Biosynthesis of Ceramide, the Central Hub of the Sphingolipid Network. J Med Chem 64:279-297 (2021) [PubMed] 
Target
Name:
Sphingomyelin phosphodiesterase 3
Synonyms:
3.1.4.12 | Cca1 | Confluent 3Y1 cell-associated protein 1 | NSMA2_RAT | Neutral sphingomyelinase 2 | Neutral sphingomyelinase II | Smpd3 | Sphingomyelin phosphodiesterase 3 | nSMase-2 | nSMase2
Type:
PROTEIN
Mol. Mass.:
71264.69
Organism:
Rat
Description:
ChEMBL_118880
Residue:
655
Sequence:
MVLYTTPFPNSCLSALHAVSWALIFPCYWLVDRLVASFIPTTYEKRQRADDPCYLQLFCTVLFTPVYLALLVAALPFAFLGFIFWSPLQSARRPYSYSRLEDKSPAGGAALLSEWKGTGAGKSFCFATANVCLLPDSLARLNNVFNTQARAKEIGQRIRNGAARPQIKIYIDSPTNTSISAASFSSLVSPQGSDGARAVPGSIKRTASVEYKGDGGRHPSDEAANGPASGEQADGSLEDSCIVRIGGEEGGRAQEADDPAPGSQARNGAGGTPKGQTPNHNQRDGDSGSLGSPSASRESLVKARAGQDSGGSGEPGSNSKLLYKTSVVKKAAARRRRHPDEAFDHEVSAFFPANLDFLCLQEVFDKRAAAKLKEQLHGYFEYILYDVGVYGCHGCCNFKCLNSGLFFASRYPVMDVAYHCYPNGCSFDALASKGALFLKVQVGSTPQDQRIVGYIACTHLHAPPEDSAIRCEQLDLLQDWLADFRKSTSSTSTANPEELVVFDVICGDLNFDNCSSDDKLEQQHSLFTRYKDPCRLGPGEEKPWAIGTLLDINGLYDEDVCTPDNLQKVLESEEGRREYLAFPTSKSPGAGQKGRKDLLKGNGRRIDYMLHAEEGLCPDWKAEVEEFSFITQLSGLTDHLPVAMRLMVSAGEEEA
  
Inhibitor
Name:
BDBM29040
Synonyms:
cambinol
Type:
Small organic molecule
Emp. Form.:
C21H16N2O2S
Mol. Mass.:
360.429
SMILES:
Oc1ccc2ccccc2c1Cc1c([nH]c(=S)[nH]c1=O)-c1ccccc1
Structure:
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