Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.49 |
| ▸ | PRKACA | P17612 | 1/20 | 0.49 |
| ▸ | CDK1 | P06493 | 6/20 | 0.46 |
| ▸ | CDK2 | P24941 | 6/20 | 0.46 |
| ▸ | CDC7 | O00311 | 6/20 | 0.45 |
| ▸ | IKBKB | O14920 | 1/20 | 0.45 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.45 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.45 |
| ▸ | PRKCB | P05771 | 1/20 | 0.45 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | CDK9 | P50750 | 1/20 | 0.45 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.45 |
| ▸ | TAOK1 | Q7L7X3 | 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 | |
|---|---|---|---|---|
| SCHEMBL6915719 | 0.94 | DYRK1A (0.49) | HSP90AA1ADORA2AAURKAPRKACACDK1 | |
| SCHEMBL7174693 | 0.93 | PRKACA (0.47) | HSP90AA1ADORA2AAURKAPRKACACDK1 | |
| SCHEMBL6826600 | 0.90 | CDK1 (0.53) | HSP90AA1ADORA2AAURKAPRKACACDK1 | |
| SCHEMBL6824620 | 0.87 | CDK1 (0.49) | PRKACACDK1CDK2CCNT1CCNB2 | |
| SCHEMBL6823684 | 0.85 | CDK2 (0.47) | PRKACACDK1CDK2CDC7CCNT1 | |
| SCHEMBL7067140 | 0.81 | CDK2 (0.46) | PRKACACDK1CDK2CDC7CCNT1 | |
| SCHEMBL6638867 | 0.77 | CDK1 (0.58) | HSP90AA1ADORA2AAURKAPRKACACDK1 | |
| SCHEMBL6826746 | 0.76 | CDK1 (0.44) | PRKACACDK1CDK2CDC7JAK2 | |
| SCHEMBL6638621 | 0.76 | CDK1 (0.53) | HSP90AA1ADORA2AAURKAPRKACACDK1 | |
| SCHEMBL6642333 | 0.76 | CDK2 (0.53) | HSP90AA1ADORA2AAURKAPRKACACDK1 |
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 1 patent. 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 |