Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RHOA | P61586 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.45 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.45 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2297554 | 0.78 | LMNA (0.50) | L3MBTL1ATMTDP1RAB9ANPC1 | |
| SCHEMBL14982062 | 0.77 | MAPK13 (0.74) | RHOACA1CA2L3MBTL1ATM | |
| SCHEMBL15544824 | 0.76 | GAA (0.64) | RHOACA1CA2GAA | |
| SCHEMBL20511106 | 0.74 | RHOA (0.61) | RHOACA1CA2L3MBTL1ATM | |
| SCHEMBL4672987 | 0.73 | NFKB1 (0.53) | RAB9ANPC1SMN1; SMN2HTTEGFR | |
| SCHEMBL18856712 | 0.73 | KDR (0.49) | EGFRAURKA | |
| SCHEMBL20242984 | 0.72 | RHOA (0.48) | RHOACA1CA2L3MBTL1ATM | |
| SCHEMBL1608163 | 0.72 | ALDH1A1 (0.48) | L3MBTL1ATMTDP1RAB9AGAA | |
| SCHEMBL656540 | 0.71 | AURKA (0.69) | EGFRAURKA | |
| SCHEMBL18856786 | 0.70 | ALDH1A1 (0.50) | L3MBTL1RAB9ANPC1SMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2870143-B1 | TRIAZOLE COMPOUNDS AS ANTIVIRALS | HOFFMANN LA ROCHE (CH) | 2017-05-17 | — | — | EP | disclosed |