Reaction Details |
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Target | Sphingosine-1-phosphate lyase 1 |
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Ligand | BDBM50018269 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1361381 (CHEMBL3293780) |
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IC50 | >100000±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 |
Synonyms: | KIAA1252 | S1PL | SGPL1 | SGPL1_HUMAN | SP-lyase 1 | SPL 1 | Sphingosine-1-phosphate aldolase | hSPL |
Type: | PROTEIN |
Mol. Mass.: | 63546.76 |
Organism: | Homo sapiens (Human) |
Description: | ChEMBL_108363 |
Residue: | 568 |
Sequence: | MPSTDLLMLKAFEPYLEILEVYSTKAKNYVNGHCTKYEPWQLIAWSVVWTLLIVWGYEFV
FQPESLWSRFKKKCFKLTRKMPIIGRKIQDKLNKTKDDISKNMSFLKVDKEYVKALPSQG
LSSSAVLEKLKEYSSMDAFWQEGRASGTVYSGEEKLTELLVKAYGDFAWSNPLHPDIFPG
LRKIEAEIVRIACSLFNGGPDSCGCVTSGGTESILMACKAYRDLAFEKGIKTPEIVAPQS
AHAAFNKAASYFGMKIVRVPLTKMMEVDVRAMRRAISRNTAMLVCSTPQFPHGVIDPVPE
VAKLAVKYKIPLHVDACLGGFLIVFMEKAGYPLEHPFDFRVKGVTSISADTHKYGYAPKG
SSLVLYSDKKYRNYQFFVDTDWQGGIYASPTIAGSRPGGISAACWAALMHFGENGYVEAT
KQIIKTARFLKSELENIKGIFVFGNPQLSVIALGSRDFDIYRLSNLMTAKGWNLNQLQFP
PSIHFCITLLHARKRVAIQFLKDIRESVTQIMKNPKAKTTGMGAIYGMAQTTVDRNMVAE
LSSVFLDSLYSTDTVTQGSQMNGSPKPH
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BDBM50018269 |
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n/a |
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Name | BDBM50018269 |
Synonyms: | CHEMBL488336 |
Type | Small organic molecule |
Emp. Form. | C9H14N2O5 |
Mol. Mass. | 230.2179 |
SMILES | CC(=O)c1nc(c[nH]1)[C@@H](O)[C@H](O)[C@H](O)CO |r| |
Structure |
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