Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 10/20 | 0.46 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | BCR | P11274 | 1/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 6/20 | 0.45 |
| ▸ | ERBB4 | Q15303 | 5/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | AKT1 | P31749 | 2/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7853244 | 0.86 | HPGD (0.48) | EGFRERBB3RAB9AERBB2ERBB4 | |
| SCHEMBL7855449 | 0.81 | EGFR (0.46) | EGFRABL1BCRERBB2AURKA | |
| SCHEMBL7853525 | 0.81 | MCHR1 (0.47) | EGFRERBB3ERBB2ERBB4JAK3 | |
| SCHEMBL8482305 | 0.79 | EGFR (0.58) | EGFRERBB2ERBB4JAK3MAPT | |
| SCHEMBL7845264 | 0.78 | EGFR (0.47) | EGFRERBB2ERBB4JAK3AURKA | |
| SCHEMBL12262264 | 0.76 | EGFR (0.61) | EGFRERBB2ERBB4JAK3 | |
| SCHEMBL8799651 | 0.75 | GALR2 (0.45) | EGFRRAB9AABL1BCRAURKA | |
| SCHEMBL27339285 | 0.75 | ABL1 (0.61) | EGFRERBB3RAB9AABL1BCR | |
| SCHEMBL8799812 | 0.74 | JAK2 (0.53) | EGFRABL1BCRJAK3MAPT | |
| SCHEMBL7844610 | 0.74 | LIMK1 (0.46) | EGFRRAB9AAURKAMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0885227-A1 | PYRIMIDO 5,4-d]PYRIMIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION | Dr. Karl Thomae GmbH (DE) | 1998-12-23 | — | — | EP | claimed |
| WO-1997032882-A1 | PYRIMIDO[5,4-d]PYRIMIDINES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION | DR. KARL THOMAE GMBH (DE) | 1997-09-12 | — | — | WO | claimed |