Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 3/20 | 0.56 |
| ▸ | BCR | P11274 | 3/20 | 0.56 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.46 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8799836 | 0.87 | EGFR (0.47) | ABL1BCRTNNI3KTRPV1MAPK1 | |
| SCHEMBL27317916 | 0.86 | TRPV1 (0.47) | ABL1BCRTNNI3KTRPV1EGFR | |
| SCHEMBL27317919 | 0.84 | EGFR (0.49) | ABL1BCRMAPK1EGFRMEN1 | |
| SCHEMBL8800556 | 0.81 | CDK2 (0.48) | TRPV1MAPK1EGFRERBB4IRAK4 | |
| SCHEMBL8798532 | 0.81 | KDR (0.46) | EGFRERBB4 | |
| SCHEMBL27344279 | 0.81 | MEN1 (0.45) | MAPK1EGFRIRAK4MEN1KMT2A | |
| SCHEMBL27338340 | 0.78 | KCNQ3 (0.48) | ABL1BCRTNNI3KMAPK1EGFR | |
| SCHEMBL29439042 | 0.77 | ABL1 (0.62) | ABL1BCRTNNI3KTRPV1EGFR | |
| SCHEMBL27339283 | 0.77 | MEN1 (0.74) | TNNI3KEGFRMEN1KMT2A | |
| SCHEMBL27408590 | 0.77 | S1PR1 (0.42) | EGFRMEN1KMT2A |
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-0779888-A1 | PYRIMIDO [5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1997-06-25 | — | — | EP | disclosed |
| WO-1996007657-A1 | PYRIMIDO[5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1996-03-14 | — | — | WO | disclosed |