Reaction Details |
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Target | Sphingosine kinase 1 |
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Ligand | BDBM50041978 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2080389 (CHEMBL4736180) |
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Ki | 3.6±n/a nM |
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Citation | Congdon, M; Fritzemeier, RG; Kharel, Y; Brown, AM; Serbulea, V; Bevan, DR; Lynch, KR; Santos, WL Probing the substitution pattern of indole-based scaffold reveals potent and selective sphingosine kinase 2 inhibitors. Eur J Med Chem212:0 (2021) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Sphingosine kinase 1 |
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Name: | Sphingosine kinase 1 |
Synonyms: | SK1 | SPHK | SPHK1 | SPHK1_HUMAN | SPK | Sphingosine kinase 1 | Sphingosine kinase 1 (SPHK1) | Sphingosine kinase types 1 (SphK1) |
Type: | Enzyme |
Mol. Mass.: | 42521.16 |
Organism: | Homo sapiens (Human) |
Description: | Q9NYA1 |
Residue: | 384 |
Sequence: | MDPAGGPRGVLPRPCRVLVLLNPRGGKGKALQLFRSHVQPLLAEAEISFTLMLTERRNHA
RELVRSEELGRWDALVVMSGDGLMHEVVNGLMERPDWETAIQKPLCSLPAGSGNALAASL
NHYAGYEQVTNEDLLTNCTLLLCRRLLSPMNLLSLHTASGLRLFSVLSLAWGFIADVDLE
SEKYRRLGEMRFTLGTFLRLAALRTYRGRLAYLPVGRVGSKTPASPVVVQQGPVDAHLVP
LEEPVPSHWTVVPDEDFVLVLALLHSHLGSEMFAAPMGRCAAGVMHLFYVRAGVSRAMLL
RLFLAMEKGRHMEYECPYLVYVPVVAFRLEPKDGKGVFAVDGELMVSEAVQGQVHPNYFW
MVSGCVEPPPSWKPQQMPPPEEPL
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BDBM50041978 |
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n/a |
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Name | BDBM50041978 |
Synonyms: | CHEMBL3134157 |
Type | Small organic molecule |
Emp. Form. | C27H31NO4S |
Mol. Mass. | 465.604 |
SMILES | Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r| |
Structure |
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