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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 | ||
| Ligand | BDBM232964 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1985904 (CHEMBL4619310) | ||
| IC50 | 14±n/a nM | ||
| Citation |  Iwaki, Y; Ohhata, A; Nakatani, S; Hisaichi, K; Okabe, Y; Hiramatsu, A; Watanabe, T; Yamamoto, S; Nishiyama, T; Kobayashi, J; Hirooka, Y; Moriguchi, H; Maeda, T; Katoh, M; Komichi, Y; Ota, H; Matsumura, N; Okada, M; Sugiyama, T; Saga, H; Imagawa, A ONO-8430506: A Novel Autotaxin Inhibitor That Enhances the Antitumor Effect of Paclitaxel in a Breast Cancer Model. ACS Med Chem Lett11:1335-1341 (2020) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 | |||
| Name: | Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 | ||
| Synonyms: | ATX | Autotaxin | Autotaxin (ATX) | E-NPP 2 | ENPP2 | ENPP2_HUMAN | Ectonucleotide Pyrophosphatase/Phosphodiesterase 2 (ENPP2) | Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 (E-NPP2) | Extracellular lysophospholipase D | LysoPLD | PDNP2 | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 99007.13 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q13822 | ||
| Residue: | 863 | ||
| Sequence: |
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| BDBM232964 | |||
| n/a | |||
| Name | BDBM232964 | ||
| Synonyms: | US9353113, Ref. Ex. 2 | ||
| Type | Small Organic Molecule | ||
| Emp. Form. | C26H27F2N3O3 | ||
| Mol. Mass. | 467.5077 | ||
| SMILES | OC(=O)[C@H]1CC[C@H](CC(=O)N2CCc3c(C2)n(Cc2ccc(F)cc2F)c2ncccc32)CC1 |r,wU:6.6,wD:3.2,(16.99,1.14,;15.95,-.01,;16.43,-1.47,;14.45,.31,;13.97,1.78,;12.47,2.1,;11.44,.95,;9.93,1.27,;8.9,.13,;9.37,-1.34,;7.39,.45,;6.92,1.91,;5.41,2.23,;4.38,1.09,;4.86,-.37,;6.36,-.69,;3.61,-1.28,;3.61,-2.82,;2.28,-3.59,;.94,-2.82,;-.39,-3.59,;-.39,-5.13,;-1.72,-5.9,;.94,-5.9,;2.28,-5.13,;3.61,-5.9,;2.36,-.37,;.86,-.69,;-.17,.45,;.3,1.91,;1.81,2.23,;2.84,1.09,;11.91,-.51,;13.42,-.83,)| | ||
| Structure | 
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