Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 4/20 | 0.55 |
| ▸ | CDK2 | P24941 | 4/20 | 0.55 |
| ▸ | RAF1 | P04049 | 4/20 | 0.45 |
| ▸ | BRAF | P15056 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.42 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | AKT1 | P31749 | 2/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 2/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6823630 | 0.94 | CDK1 (0.49) | CDK1CDK2RAF1BRAF | |
| SCHEMBL6918875 | 0.90 | CDK1 (0.55) | CDK1CDK2 | |
| SCHEMBL6825113 | 0.89 | CDK1 (0.44) | CDK1CDK2RAF1BRAF | |
| SCHEMBL6820798 | 0.83 | CDK1 (0.40) | CDK1CDK2RAF1BRAF | |
| SCHEMBL7068093 | 0.83 | RAF1 (0.45) | CDK1CDK2RAF1BRAFHPGD | |
| SCHEMBL6820704 | 0.82 | CDK1 (0.59) | CDK1CDK2HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL6824190 | 0.82 | MAPK14 (0.43) | CDK1CDK2ALDH1A1SMN1; SMN2 | |
| SCHEMBL6824305 | 0.81 | MAPK14 (0.48) | CDK1CDK2HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL6824361 | 0.81 | MAPK14 (0.40) | CDK1CDK2HPGDALDH1A1LMNA | |
| SCHEMBL6826271 | 0.81 | KDM4E (0.41) | CDK1CDK2ALDH1A1SMN1; SMN2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | claimed |
| WO-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | disclosed |