Reaction Details |
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Target | Sphingomyelin phosphodiesterase |
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Ligand | BDBM50520397 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1880155 (CHEMBL4381549) |
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IC50 | 3380±n/a nM |
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Citation | Yang, K; Yu, J; Nong, K; Wang, Y; Niu, A; Chen, W; Dong, J; Wang, J Discovery of Potent, Selective, and Direct Acid Sphingomyelinase Inhibitors with Antidepressant Activity. J Med Chem63:961-974 (2020) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Sphingomyelin phosphodiesterase |
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Name: | Sphingomyelin phosphodiesterase |
Synonyms: | 3.1.4.12 | ASM | ASM_HUMAN | Acid sphingomyelinase | SMPD1 | Sphingomyelin phosphodiesterase | aSMase |
Type: | PROTEIN |
Mol. Mass.: | 69945.03 |
Organism: | Homo sapiens |
Description: | ChEMBL_11570 |
Residue: | 631 |
Sequence: | MPRYGASLRQSCPRSGREQGQDGTAGAPGLLWMGLVLALALALALALALSDSRVLWAPAE
AHPLSPQGHPARLHRIVPRLRDVFGWGNLTCPICKGLFTAINLGLKKEPNVARVGSVAIK
LCNLLKIAPPAVCQSIVHLFEDDMVEVWRRSVLSPSEACGLLLGSTCGHWDIFSSWNISL
PTVPKPPPKPPSPPAPGAPVSRILFLTDLHWDHDYLEGTDPDCADPLCCRRGSGLPPASR
PGAGYWGEYSKCDLPLRTLESLLSGLGPAGPFDMVYWTGDIPAHDVWHQTRQDQLRALTT
VTALVRKFLGPVPVYPAVGNHESTPVNSFPPPFIEGNHSSRWLYEAMAKAWEPWLPAEAL
RTLRIGGFYALSPYPGLRLISLNMNFCSRENFWLLINSTDPAGQLQWLVGELQAAEDRGD
KVHIIGHIPPGHCLKSWSWNYYRIVARYENTLAAQFFGHTHVDEFEVFYDEETLSRPLAV
AFLAPSATTYIGLNPGYRVYQIDGNYSGSSHVVLDHETYILNLTQANIPGAIPHWQLLYR
ARETYGLPNTLPTAWHNLVYRMRGDMQLFQTFWFLYHKGHPPSEPCGTPCRLATLCAQLS
ARADSPALCRHLMPDGSLPEAQSLWPRPLFC
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BDBM50520397 |
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n/a |
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Name | BDBM50520397 |
Synonyms: | CHEMBL4465034 |
Type | Small organic molecule |
Emp. Form. | C20H25NO3 |
Mol. Mass. | 327.4174 |
SMILES | CCCCCCc1ccc(COc2cccc(c2)C(=O)NO)cc1 |
Structure |
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