Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 10/20 | 0.53 |
| ▸ | CDK2 | P24941 | 8/20 | 0.53 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.50 |
| ▸ | CDK5R1 | Q15078 | 6/20 | 0.50 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | PRKACA | P17612 | 5/20 | 0.45 |
| ▸ | CCNB2 | O95067 | 4/20 | 0.45 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.45 |
| ▸ | PRKACG | P22612 | 4/20 | 0.45 |
| ▸ | PRKACB | P22694 | 4/20 | 0.45 |
| ▸ | GSK3B | P49841 | 4/20 | 0.45 |
| ▸ | CCNB3 | Q8WWL7 | 4/20 | 0.45 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.45 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.45 |
| ▸ | CSNK1E | P49674 | 2/20 | 0.45 |
| ▸ | CSNK1G2 | P78368 | 2/20 | 0.45 |
| ▸ | CSNK1G1 | Q9HCP0 | 2/20 | 0.45 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.45 |
| ▸ | PRKCG | P05129 | 1/20 | 0.45 |
| ▸ | PRKCB | P05771 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6824620 | 0.94 | CDK1 (0.49) | CDK1CDK2CDK5CDK5R1KDM4C | |
| SCHEMBL6915719 | 0.93 | DYRK1A (0.49) | CDK1CDK2CDK5CDK5R1KDM4C | |
| SCHEMBL6823684 | 0.92 | CDK2 (0.47) | CDK1CDK2CDK5CDK5R1KDM4C | |
| SCHEMBL6920709 | 0.90 | HSP90AA1 (0.49) | CDK1CDK2CDK5CDK5R1KDM4C | |
| SCHEMBL7174693 | 0.88 | PRKACA (0.47) | CDK1CDK2CDK5CDK5R1KDM4C | |
| SCHEMBL7067140 | 0.87 | CDK2 (0.46) | CDK1CDK2CDK5CDK5R1KDM4C | |
| SCHEMBL6826746 | 0.85 | CDK1 (0.44) | CDK1CDK2CDK5CDK5R1KDM4C | |
| SCHEMBL5803933 | 0.81 | CDK1 (0.58) | CDK1CDK2CDK5CDK5R1KDM4C | |
| SCHEMBL6826566 | 0.80 | CYP2D6 (0.46) | CDK1CDK2 | |
| SCHEMBL6922661 | 0.80 | CDK2 (0.51) | CDK1CDK2GSK3BCSNK1A1CSNK1D |
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 3 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 | disclosed |
| WO-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | disclosed |
| WO-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | disclosed |