Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.46 |
| ▸ | EP300 | Q09472 | 1/20 | 0.45 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PRKDC | P78527 | 1/20 | 0.43 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27322788 | 0.91 | KDM4E (0.56) | SCN9AEP300CREBBPALDH1A1CHRM4 | |
| SCHEMBL8798398 | 0.88 | SCN9A (0.48) | SCN9AALDH1A1SMN1; SMN2PDGFRBKDM4E | |
| SCHEMBL27335944 | 0.86 | USP2 (0.50) | SCN9AALDH1A1PDGFRBKDM4EUSP2 | |
| SCHEMBL8798331 | 0.86 | PDGFRB (0.47) | SCN9AALDH1A1SMN1; SMN2PDGFRBKDM4E | |
| SCHEMBL8808651 | 0.84 | EP300 (0.47) | EP300CREBBPALDH1A1RAB9AKDM4E | |
| SCHEMBL8808658 | 0.84 | EP300 (0.47) | EP300CREBBPALDH1A1RAB9AKDM4E | |
| SCHEMBL27323457 | 0.80 | EGFR (0.53) | SCN9APDGFRBEGFRPIK3CAPRKDC | |
| SCHEMBL8315857 | 0.77 | EGFR (0.49) | SCN9ASMN1; SMN2EGFRKMT2APIK3CA | |
| SCHEMBL8805243 | 0.77 | EGFR (0.55) | SCN9AEGFR | |
| SCHEMBL8318909 | 0.77 | BRAF (0.53) | EGFR |
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 |