Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 9/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.43 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.43 |
| ▸ | EEF2K | O00418 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL8580642 | 0.92 | PTGS2 (0.57) | PTGS2PTGS1CYP2C9CYP1A2GAA | |
| SCHEMBL8580941 | 0.81 | TP53 (0.45) | PTGS2PTGS1CYP2C9CYP1A2ADAMTS5 | |
| SCHEMBL8536499 | 0.74 | PTGS2 (0.55) | PTGS2PTGS1CYP2C9CYP1A2GAA | |
| SCHEMBL8536501 | 0.74 | PTGS2 (0.55) | PTGS2PTGS1CYP2C9CYP1A2GAA | |
| SCHEMBL8535412 | 0.73 | PTGS2 (0.85) | PTGS2PTGS1GAANPC1MAPT | |
| SCHEMBL8535410 | 0.73 | PTGS2 (0.85) | PTGS2PTGS1GAANPC1MAPT | |
| SCHEMBL8582453 | 0.73 | CYP1A2 (0.56) | PTGS2PTGS1CYP1A2ADAMTS5TP53 | |
| SCHEMBL8580718 | 0.73 | MAPT (0.42) | PTGS2PTGS1CYP2C9CYP1A2GAA | |
| SCHEMBL8991978 | 0.71 | PTGS2 (0.48) | PTGS2PTGS1CYP2C9CYP1A2GAA | |
| SCHEMBL8893231 | 0.71 | PTGS2 (0.48) | PTGS2PTGS1CYP2C9CYP1A2GAA |
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-5731336-A | USING ARYL-SUBSTITUTED RHODAMINES | ELI LILLY AND COMPANY (US) | 1998-03-24 | — | — | US | disclosed |