Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 5/20 | 0.59 |
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.59 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.45 |
| ▸ | TAS2R14 | Q9NYV8 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6966682 | 0.81 | POLB (0.62) | POLBTAS2R14CNR2 | |
| SCHEMBL6962607 | 0.79 | CNR2 (0.59) | POLBTAS2R14ALDH1A1CNR2 | |
| SCHEMBL7961836 | 0.78 | KEAP1 (0.68) | KEAP1NFE2L2PPARGTAS2R14GLA | |
| SCHEMBL9972493 | 0.78 | KEAP1 (0.62) | KEAP1NFE2L2PPARGTAS2R14GLA | |
| SCHEMBL7014081 | 0.77 | KEAP1 (0.53) | KEAP1NFE2L2POLBTAS2R14ALDH1A1 | |
| SCHEMBL4771204 | 0.77 | KEAP1 (0.66) | KEAP1NFE2L2PPARGPOLBALDH1A1 | |
| SCHEMBL8607609 | 0.76 | KEAP1 (0.64) | KEAP1NFE2L2PPARGTAS2R14GLA | |
| SCHEMBL8606028 | 0.75 | CA9 (0.60) | KEAP1NFE2L2PPARGTAS2R14GLA | |
| SCHEMBL6952679 | 0.74 | HCRTR2 (0.48) | KEAP1NFE2L2POLBHCRTR2GLA | |
| SCHEMBL8200276 | 0.74 | KEAP1 (0.62) | KEAP1NFE2L2PPARGTAS2R14GLA |
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-2534138-B1 | 1,2,3-TRIAZOLE-BASED PEPTIDOMIMETIC INTEGRIN INHIBITORS FOR THE DIAGNOSIS AND THERAPY OF TUMORS | UNIVERSITA' DEGLI STUDI DI FIRENZE (IT) | 2017-01-25 | — | — | EP | disclosed |
| US-8809338-B2 | 1,2,3-triazole-based peptidomimetic integrin inhibitors for the diagnosis and therapy of tumors | UNIVERSITA' DEGLI STUDI DI FIRENZE (IT) | 2014-08-19 | — | — | US | disclosed |