| BioID | bio3397 |
|---|
| Name | TEMUTERKIB |
|---|
| ChEMBL ID | CHEMBL4650285 |
|---|
| Molecular Formula | C22H27N7O2S |
|---|
| Molecular Weight | 453.57 |
|---|
| Molecular Weight (Monoisotopic) | 453.1947 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 2 |
|---|
| Target ID | Tar18 |
|---|
| Target Name | Serine/threonine-protein kinase cot (COT) |
|---|
| Synonyms | LY 3214996|LY-3214996|LY3214996|TEMUTERKIB |
|---|
| Smiles | Cn1nccc1Nc1nccc(-c2cc3c(s2)C(C)(C)N(CCN2CCOCC2)C3=O)n1 |
|---|
| Inchi | InChI=1S/C22H27N7O2S/c1-22(2)19-15(20(30)29(22)9-8-28-10-12-31-13-11-28)14-17(32-19)16-4-6-23-21(25-16)26-18-5-7-24-27(18)3/h4-7,14H,8-13H2,1-3H3,(H,23,25,26) |
|---|
| Inchi Key | JNPRPMBJODOFEC-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 6.0 |
|---|
| Bioactivities | 26.0 |
|---|
| Np Likeness Score | -1.55 |
|---|
| Records Key | ['TEMUTERKIB', 'EUB0001885a', 'TEMUTERKIB', '21; LY3214996', 'LY3214996'] |
|---|
| Records Name | ['TEMUTERKIB', 'LY3214996', 'TEMUTERKIB', '6,6-dimethyl-2-(2-(1-methyl-1H-pyrazol-5-ylamino)pyrimidin-4-yl)-5-(2-morpholinoethyl)-5,6-dihydro-4H-thieno[2,3-c]pyrrol-4-one', '6,6-dimethyl-2-(2-((1-methyl-1H-pyrazol-5-yl)amino)pyrimidin-4-yl)-5-(2-morpholinoethyl)-5,6-dihydro-4H-thieno[2,3-c]pyrrol-4-one'] |
|---|
| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
