Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 1.00 |
| ▸ | IGF1R | P08069 | 4/20 | 0.77 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.72 |
| ▸ | KDR | P35968 | 1/20 | 0.72 |
| ▸ | MAPT | P10636 | 3/20 | 0.68 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.68 |
| ▸ | MEN1 | O00255 | 2/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.68 |
| ▸ | NPC1 | O15118 | 2/20 | 0.68 |
| ▸ | RAB9A | P51151 | 2/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 1/20 | 0.68 |
| ▸ | PIK3CG | P48736 | 5/20 | 0.67 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.67 |
| ▸ | PIK3CB | P42338 | 4/20 | 0.67 |
| ▸ | SYK | P43405 | 2/20 | 0.62 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.61 |
| ▸ | AURKA | O14965 | 2/20 | 0.59 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.59 |
| ▸ | IKBKB | O14920 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL31046394 | 0.96 | EGFR (0.92) | EGFRIGF1RROCK1KDRMAPT | |
| SCHEMBL17915954 | 0.92 | EGFR (0.84) | EGFRIGF1RROCK1KDRMAPT | |
| SCHEMBL1116424 | 0.91 | EGFR (0.83) | EGFRIGF1RROCK1KDRMAPT | |
| SCHEMBL6976694 | 0.90 | EGFR (0.81) | EGFRIGF1RROCK1KDRPIK3CG | |
| SCHEMBL301779 | 0.88 | EGFR (0.78) | EGFRIGF1RROCK1KDRMAPT | |
| SCHEMBL270162 | 0.88 | EGFR (0.78) | EGFRIGF1RROCK1KDRMAPT | |
| SCHEMBL6971010 | 0.86 | EGFR (0.74) | EGFRIGF1RROCK1KDRPIK3CG | |
| SCHEMBL91589 | 0.85 | EGFR (0.74) | EGFRIGF1RROCK1KDRMAPK1 | |
| SCHEMBL3458531 | 0.85 | EGFR (0.72) | EGFRIGF1RROCK1KDRMAPT | |
| SCHEMBL2284267 | 0.84 | EGFR (0.72) | EGFRIGF1RROCK1MAPTMAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4658477-B2 | — | — | 2011-03-23 | — | — | JP | claimed |
| EP-1471915-A4 | 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES | RIGEL PHARMACEUTICALS INC (US) | 2006-02-15 | — | — | EP | claimed |
| JP-2005516046-A | — | — | 2005-06-02 | — | — | JP | claimed |
| EP-1471915-A2 | 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES | Rigel Pharmaceuticals, Inc. (US) | 2004-11-03 | — | — | EP | claimed |
| WO-2003063794-A2 | 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES | RIGEL PHARMACEUTICALS, INC. (US) | 2003-08-07 | — | — | WO | claimed |