Reaction Details |
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Target | Sphingomyelin phosphodiesterase 3 |
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Ligand | BDBM50521429 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1884279 (CHEMBL4385861) |
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IC50 | 130±n/a nM |
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Citation | Stepanek, O; Hin, N; Thomas, AG; Dash, RP; Alt, J; Rais, R; Rojas, C; Slusher, BS; Tsukamoto, T Neutral sphingomyelinase 2 inhibitors based on the 4-(1H-imidazol-2-yl)-2,6-dialkoxyphenol scaffold. Eur J Med Chem170:276-289 (2019) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Sphingomyelin phosphodiesterase 3 |
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Name: | Sphingomyelin phosphodiesterase 3 |
Synonyms: | 3.1.4.12 | NSMA2_HUMAN | Neutral sphingomyelinase 2 | Neutral sphingomyelinase II | SMPD3 | Sphingomyelin phosphodiesterase 3 | nSMase-2 | nSMase2 |
Type: | PROTEIN |
Mol. Mass.: | 71072.54 |
Organism: | Homo sapiens |
Description: | ChEMBL_119220 |
Residue: | 655 |
Sequence: | MVLYTTPFPNSCLSALHCVSWALIFPCYWLVDRLAASFIPTTYEKRQRADDPCCLQLLCT
ALFTPIYLALLVASLPFAFLGFLFWSPLQSARRPYIYSRLEDKGLAGGAALLSEWKGTGP
GKSFCFATANVCLLPDSLARVNNLFNTQARAKEIGQRIRNGAARPQIKIYIDSPTNTSIS
AASFSSLVSPQGGDGVARAVPGSIKRTASVEYKGDGGRHPGDEAANGPASGDPVDSSSPE
DACIVRIGGEEGGRPPEADDPVPGGQARNGAGGGPRGQTPNHNQQDGDSGSLGSPSASRE
SLVKGRAGPDTSASGEPGANSKLLYKASVVKKAAARRRRHPDEAFDHEVSAFFPANLDFL
CLQEVFDKRAATKLKEQLHGYFEYILYDVGVYGCQGCCSFKCLNSGLLFASRYPIMDVAY
HCYPNKCNDDALASKGALFLKVQVGSTPQDQRIVGYIACTHLHAPQEDSAIRCGQLDLLQ
DWLADFRKSTSSSSAANPEELVAFDVVCGDFNFDNCSSDDKLEQQHSLFTHYRDPCRLGP
GEEKPWAIGTLLDTNGLYDEDVCTPDNLQKVLESEEGRREYLAFPTSKSSGQKGRKELLK
GNGRRIDYMLHAEEGLCPDWKAEVEEFSFITQLSGLTDHLPVAMRLMVSSGEEEA
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BDBM50521429 |
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n/a |
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Name | BDBM50521429 |
Synonyms: | CHEMBL4436316 |
Type | Small organic molecule |
Emp. Form. | C18H18N2O3 |
Mol. Mass. | 310.3471 |
SMILES | COc1cc(cc(OC)c1O)-c1nc(c[nH]1)-c1ccc(C)cc1 |
Structure |
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