Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 11/20 | 0.46 |
| ▸ | ULK1 | O75385 | 4/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.42 |
| ▸ | BRAF | P15056 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | ULK2 | Q8IYT8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27338340 | 0.85 | KCNQ3 (0.48) | S1PR1EGFRKCNH2 | |
| SCHEMBL8799653 | 0.81 | ABL1 (0.56) | EGFRERBB4 | |
| SCHEMBL27317919 | 0.79 | EGFR (0.49) | S1PR1EGFR | |
| SCHEMBL8800556 | 0.77 | CDK2 (0.48) | KDRS1PR1BRAFEGFRERBB4 | |
| SCHEMBL8799836 | 0.77 | EGFR (0.47) | S1PR1EGFRERBB4 | |
| SCHEMBL7851279 | 0.77 | KCNH2 (0.66) | KDREGFRKCNH2 | |
| SCHEMBL7846724 | 0.77 | KCNH2 (0.66) | KDREGFRKCNH2 | |
| SCHEMBL27623053 | 0.76 | KCNH2 (0.52) | EGFRKCNH2 | |
| SCHEMBL8800821 | 0.76 | EGFR (0.47) | KDRULK1S1PR1EGFRERBB4 | |
| SCHEMBL27323499 | 0.76 | MEN1 (0.51) | EGFRERBB4 |
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 |