Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | PLAU | P00749 | 1/20 | 0.53 |
| ▸ | PPARG | P37231 | 2/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CFD | P00746 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL20217393 | 0.85 | ALDH1A1 (0.57) | ALDH1A1HPGDPLAUPPARGLMNA | |
| SCHEMBL27214488 | 0.84 | L3MBTL1 (0.56) | ALDH1A1HPGDPLAUPPARGHDAC2 | |
| SCHEMBL20217177 | 0.83 | SMN1; SMN2 (0.54) | ALDH1A1HPGDPPARGRAB9ALMNA | |
| SCHEMBL20217165 | 0.82 | KDM4E (0.58) | ALDH1A1HPGDRAB9ALMNAL3MBTL1 | |
| SCHEMBL10768550 | 0.81 | ALDH1A1 (0.70) | ALDH1A1HPGDPLAUPPARGHDAC2 | |
| SCHEMBL25516265 | 0.80 | MAPT (0.43) | ALDH1A1HPGDPLAUHDAC6LMNA | |
| Hydrochloric Acid SCHEMBL10802424 | 0.80 | ALDH1A1 (0.68) | ALDH1A1HPGDPLAUPPARGHDAC2 | |
| SCHEMBL4928213 | 0.79 | PLAU (0.59) | ALDH1A1HPGDPLAUHDAC2HDAC8 | |
| SCHEMBL10319381 | 0.78 | ALDH1A1 (0.70) | ALDH1A1HPGDPLAUHDAC2HDAC8 | |
| SCHEMBL13175594 | 0.77 | L3MBTL1 (0.68) | ALDH1A1HPGDPLAURAB9ALMNA |
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-2766352-B1 | INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIV HEALTH NETWORK UHN (CA) | 2018-06-06 | — | — | EP | disclosed |