Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | USP2 | O75604 | 5/20 | 0.50 |
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.48 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | JAK3 | P52333 | 1/20 | 0.44 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17220188 | 0.81 | ALDH1A1 (0.52) | ALDH1A1LMNAHTTMAPTUSP2 | |
| SCHEMBL17220343 | 0.80 | ROCK1 (0.47) | ALDH1A1LMNAHTTMAPTUSP2 | |
| SCHEMBL17220118 | 0.77 | ALDH1A1 (0.61) | ALDH1A1LMNAHTTMAPTUSP2 | |
| SCHEMBL12134685 | 0.73 | ALDH1A1 (0.71) | ALDH1A1LMNAHTTMAPTUSP2 | |
| SCHEMBL17486069 | 0.70 | JAK2 (0.53) | ALDH1A1LMNAHTTMAPTUSP2 | |
| SCHEMBL5063173 | 0.70 | JAK2 (0.53) | ALDH1A1LMNAHTTMAPTUSP2 | |
| SCHEMBL796470 | 0.68 | ROCK1 (0.51) | ALDH1A1LMNAHTTMAPTUSP2 | |
| SCHEMBL5245431 | 0.68 | ROCK1 (0.63) | ALDH1A1LMNAHTTMAPTUSP2 | |
| Hydrochloric Acid SCHEMBL5749583 | 0.67 | NUDT1 (0.69) | ALDH1A1LMNAHTTMAPTUSP2 | |
| SCHEMBL797206 | 0.66 | ALDH1A1 (0.50) | ALDH1A1LMNAHTTMAPTUSP2 |
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-2616465-B1 | TRIAZINE-OXADIAZOLES | NOVARTIS AG (CH) | 2015-11-04 | — | — | EP | disclosed |