| BioID | bio3565 |
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| Name | EBVACICLIB |
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| ChEMBL ID | CHEMBL4446357 |
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| Molecular Formula | C20H27F2N5O4S |
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| Molecular Weight | 471.53 |
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| Molecular Weight (Monoisotopic) | 471.1752 |
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| Type | Small molecule |
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| Max Phase | Phase 2 |
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| Target ID | Tar18 |
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| Target Name | Serine/threonine-protein kinase cot (COT) |
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| Synonyms | EBVACICLIB|PF-06873600 |
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| Smiles | C[C@@]1(O)CCC[C@H]1n1c(=O)c(C(F)F)cc2cnc(NC3CCN(S(C)(=O)=O)CC3)nc21 |
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| Inchi | InChI=1S/C20H27F2N5O4S/c1-20(29)7-3-4-15(20)27-17-12(10-14(16(21)22)18(27)28)11-23-19(25-17)24-13-5-8-26(9-6-13)32(2,30)31/h10-11,13,15-16,29H,3-9H2,1-2H3,(H,23,24,25)/t15-,20-/m1/s1 |
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| Inchi Key | QIEKHLDZKRQLLN-FOIQADDNSA-N |
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| Molecular Species | NEUTRAL |
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| Targets | 22.0 |
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| Bioactivities | 50.0 |
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| Np Likeness Score | -0.85 |
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| Records Key | ['PF-06873600', 'EBVACICLIB', '10', 'EBVACICLIB', '1; PF-06873600', 'Ebvaciclib', '76; PF06873600', '22; PF-06873600', 'PF-06873600'] |
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| Records Name | ['6-(difluoromethyl)-8-((1R,2R)-2-hydroxy-2-methylcyclopentyl)-2-(1-(methylsulfonyl)piperidin-4-ylamino)pyrido[2,3-d]pyrimidin-7(8H)-one', 'EBVACICLIB', '6-(difluoromethyl)-8-[(1R,2R)-2-hydroxy-2-methyl-cyclopentyl]-2-[(1-methylsulfonyl-4-piperidyl)amino]pyrido[2,3-d]pyrimidin-7-one', 'EBVACICLIB', '6-(difluoromethyl)-8-((1R,2R)-2-hydroxy-2-methylcyclopentyl)-2-((1-(methylsulfonyl)piperidin-4-yl)amino)pyrido[2,3-d]pyrimidin-7(8H)-one', 'Ebvaciclib', '6-(difluoromethyl)-8-((1R,2R)-2-hydroxy-2-methylcyclopentyl)-2-(1-(methylsulfonyl)piperidin-4-ylamino)pyrido[2,3-d]pyrimidin-7(8H)-one', '6-(Difluoromethyl)-8-[(1R,2R)-2-hydroxy-2-methylcyclopentyl]-2-{[1-(methanesulfonyl)piperidin-4-yl]amino}pyrido[2,3-d]-pyrimidin-7(8H)-one', '6-(Difluoromethyl)-8-((1R,2R)-2-hydroxy-2-methylcyclopentyl)-2-((1-(methylsulfonyl)piperidin-4-yl)amino)pyrido[2,3-d]pyrimidin-7(8H)-one'] |
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| Withdrawn Flag | False |
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| Orphan | 0 |
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