Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | ERBB3 | P21860 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | BCR | P11274 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.46 |
| ▸ | NPY1R | P25929 | 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 | |
|---|---|---|---|---|
| SCHEMBL1387354 | 0.89 | EGFR (0.50) | EGFRALDH1A1MAPK1HTTERBB3 | |
| SCHEMBL7771239 | 0.87 | EGFR (0.54) | EGFRMAPK1HTTERBB3MEN1 | |
| SCHEMBL7777399 | 0.84 | EGFR (0.55) | EGFRMAPK1HTTERBB3MEN1 | |
| SCHEMBL8318193 | 0.82 | EGFR (0.55) | EGFRMAPK1HTTERBB3MEN1 | |
| SCHEMBL1387422 | 0.82 | EGFR (0.65) | EGFRERBB3MEN1KMT2ARAB9A | |
| SCHEMBL8320776 | 0.82 | EGFR (0.53) | EGFRMAPK1HTTERBB3MEN1 | |
| SCHEMBL7776054 | 0.82 | EGFR (0.58) | EGFRMAPK1HTTERBB3MEN1 | |
| SCHEMBL7778617 | 0.81 | EGFR (0.64) | EGFRERBB3MEN1KMT2ARAB9A | |
| SCHEMBL7775654 | 0.80 | ALDH1A1 (0.52) | EGFRALDH1A1ERBB3MEN1KMT2A | |
| SCHEMBL7771258 | 0.79 | EGFR (0.55) | EGFRMAPK1HTTERBB3MEN1 |
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-0733045-B1 | 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS | ASTRAZENECA AB (SE) | 2001-08-16 | — | — | EP | disclosed |
| US-5880130-A | TREATMENT OF CELL-PROLIFERATION DISEASES | ZENECA LIMITED (GB) | 1999-03-09 | — | — | US | disclosed |