Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 13/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.49 |
| ▸ | STAT3 | P40763 | 3/20 | 0.47 |
| ▸ | PTGES | O14684 | 2/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.47 |
| ▸ | RELA | Q04206 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | MET | P08581 | 2/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 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 | |
|---|---|---|---|---|
| SCHEMBL5666874 | 0.90 | ALOX5 (0.50) | ALOX5PTGS1PTGS2STAT3PTGES | |
| SCHEMBL5666872 | 0.90 | ALOX5 (0.50) | ALOX5PTGS1PTGS2STAT3PTGES | |
| SCHEMBL5665894 | 0.82 | CYP1A2 (0.51) | ALOX5PTGS1PTGS2STAT3PTGES | |
| SCHEMBL5667592 | 0.79 | ALDH1A1 (0.59) | CYP1A2CYP2D6KMT2AKDM4EGAA | |
| SCHEMBL5667595 | 0.79 | ALDH1A1 (0.59) | CYP1A2CYP2D6KMT2AKDM4EGAA | |
| SCHEMBL5667477 | 0.78 | TOP2A (0.45) | ALOX5PTGS1PTGS2STAT3PTGES | |
| SCHEMBL5667474 | 0.78 | TOP2A (0.45) | ALOX5PTGS1PTGS2STAT3PTGES | |
| SCHEMBL5668058 | 0.75 | CYP1A2 (0.59) | ALOX5PTGS1PTGS2STAT3PTGES | |
| SCHEMBL5668055 | 0.75 | CYP1A2 (0.59) | ALOX5PTGS1PTGS2STAT3PTGES | |
| SCHEMBL5663406 | 0.73 | ALOX5 (0.56) | ALOX5PTGS1PTGS2STAT3PTGES |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004026242-A2 | SUBSTITUTED KETOPHOSPHONATE INHIBITORS OF TUMOR CELL PROLIFERATION | ILEX ONCOLOGY RESEARCH, SARL (CH) | 2004-04-01 | — | — | WO | disclosed |