Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.38 |
| ▸ | ACLY | P53396 | 1/20 | 0.37 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8796477 | 0.86 | TDP1 (0.50) | PTGS2ROCK2LOXL2TDP1ACLY | |
| SCHEMBL16618470 | 0.83 | PTGS2 (0.47) | PTGS2ROCK2LOXL2BCAT2ACLY | |
| SCHEMBL9167775 | 0.81 | EGFR (0.53) | PTGS2EGFR | |
| SCHEMBL9166730 | 0.80 | ESR2 (0.56) | PTGS2ROCK2EGFR | |
| SCHEMBL9436730 | 0.77 | PTGS2 (0.50) | PTGS2ROCK2LOXL2PTGDR2TDP1 | |
| Hydrochloric Acid SCHEMBL8895292 | 0.76 | SLC9A1 (0.59) | — | |
| SCHEMBL9163491 | 0.76 | MKNK1 (0.50) | PTGS2ROCK2EGFR | |
| SCHEMBL27765267 | 0.76 | ALOX5 (0.55) | PTGS2LOXL2PTGDR2ACLY | |
| SCHEMBL9189128 | 0.74 | SLC9A1 (0.46) | LOXL2 | |
| Hydrochloric Acid SCHEMBL8895287 | 0.74 | ROCK2 (0.46) | PTGS2ROCK2LOXL2SCN9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5292755-A | USPA benzolyguanidines | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-03-08 | — | — | US | disclosed |
| US-5091394-A | BENZOYLGUANIDINES, A PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICAMENTS AND MEDICAMENTS CONTAINING THEM | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-02-25 | — | — | US | disclosed |