| Reaction Details |
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 | Report a problem with these data |
| Target | Sphingosine-1-phosphate lyase 1 |
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| Ligand | BDBM50158336 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1361381 (CHEMBL3293780) |
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| IC50 | 52000±n/a nM |
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| Citation |  Weiler, S; Braendlin, N; Beerli, C; Bergsdorf, C; Schubart, A; Srinivas, H; Oberhauser, B; Billich, A Orally active 7-substituted (4-benzylphthalazin-1-yl)-2-methylpiperazin-1-yl]nicotinonitriles as active-site inhibitors of sphingosine 1-phosphate lyase for the treatment of multiple sclerosis. J Med Chem57:5074-84 (2014) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Sphingosine-1-phosphate lyase 1 |
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| Name: | Sphingosine-1-phosphate lyase 1 |
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| Synonyms: | KIAA1252 | S1PL | SGPL1 | SGPL1_HUMAN | SP-lyase 1 | SPL 1 | Sphingosine-1-phosphate aldolase | hSPL |
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| Type: | PROTEIN |
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| Mol. Mass.: | 63546.76 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_108363 |
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| Residue: | 568 |
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| Sequence: | MPSTDLLMLKAFEPYLEILEVYSTKAKNYVNGHCTKYEPWQLIAWSVVWTLLIVWGYEFV
FQPESLWSRFKKKCFKLTRKMPIIGRKIQDKLNKTKDDISKNMSFLKVDKEYVKALPSQG
LSSSAVLEKLKEYSSMDAFWQEGRASGTVYSGEEKLTELLVKAYGDFAWSNPLHPDIFPG
LRKIEAEIVRIACSLFNGGPDSCGCVTSGGTESILMACKAYRDLAFEKGIKTPEIVAPQS
AHAAFNKAASYFGMKIVRVPLTKMMEVDVRAMRRAISRNTAMLVCSTPQFPHGVIDPVPE
VAKLAVKYKIPLHVDACLGGFLIVFMEKAGYPLEHPFDFRVKGVTSISADTHKYGYAPKG
SSLVLYSDKKYRNYQFFVDTDWQGGIYASPTIAGSRPGGISAACWAALMHFGENGYVEAT
KQIIKTARFLKSELENIKGIFVFGNPQLSVIALGSRDFDIYRLSNLMTAKGWNLNQLQFP
PSIHFCITLLHARKRVAIQFLKDIRESVTQIMKNPKAKTTGMGAIYGMAQTTVDRNMVAE
LSSVFLDSLYSTDTVTQGSQMNGSPKPH
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| BDBM50158336 |
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| n/a |
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| Name | BDBM50158336 |
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| Synonyms: | 2-(4-octylphenethyl)-2-aminopropane-1,3-diol | 2-Amino-2-[2-(4-octyl-phenyl)-ethyl]-propane-1,3-diol | 2-amino-2-(4-octylphenethyl)propane-1,3-diol | 2-amino-2-(4-octylphenyl)ethylpropane-1,3-diol | CHEMBL314854 | FINGOLIMOD | FINGOLIMOD HYDROCHLORIDE |
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| Type | Small organic molecule |
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| Emp. Form. | C19H33NO2 |
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| Mol. Mass. | 307.4708 |
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| SMILES | CCCCCCCCc1ccc(CCC(N)(CO)CO)cc1 |
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| Structure | 
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