Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.42 |
| ▸ | BTK | Q06187 | 3/20 | 0.42 |
| ▸ | ITK | Q08881 | 2/20 | 0.42 |
| ▸ | NAMPT | P43490 | 5/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.37 |
| ▸ | MEF2D | Q14814 | 3/20 | 0.37 |
| ▸ | DHFR | P00374 | 2/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.37 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.37 |
| ▸ | SIRT3 | Q9NTG7 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 2/20 | 0.35 |
| ▸ | BLK | P51451 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7493481 | 1.00 | EGFR (0.42) | EGFRBTKITKNAMPTHDAC4 | |
| SCHEMBL6794724 | 0.92 | EGFR (0.44) | EGFRBTKITKNAMPTHDAC4 | |
| SCHEMBL6794732 | 0.92 | EGFR (0.44) | EGFRBTKITKNAMPTHDAC4 | |
| Hydrochloric Acid SCHEMBL6796140 | 0.92 | EGFR (0.47) | EGFRBTKITKNAMPTHDAC4 | |
| Hydrochloric Acid SCHEMBL6796145 | 0.92 | EGFR (0.47) | EGFRBTKITKNAMPTHDAC4 | |
| SCHEMBL6797628 | 0.91 | EGFR (0.45) | EGFRBTKITKNAMPTHDAC4 | |
| SCHEMBL6797634 | 0.91 | EGFR (0.45) | EGFRBTKITKNAMPTHDAC4 | |
| SCHEMBL7360146 | 0.90 | EGFR (0.43) | EGFRBTKITKNAMPTHDAC4 | |
| SCHEMBL7360140 | 0.90 | EGFR (0.43) | EGFRBTKITKNAMPTHDAC4 | |
| SCHEMBL8063774 | 0.89 | EGFR (0.40) | EGFRBTKITKNAMPTDHFR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6117875-A | Pyrido (2,3-B) pyrazine derivatives | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-09-12 | — | — | US | disclosed |