Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.42 |
| ▸ | GRN | P28799 | 1/20 | 0.41 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.40 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.40 |
| ▸ | PRKCG | P05129 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20217243 | 0.88 | KDM4E (0.51) | ALDH1A1LMNAPPARGKDM4E | |
| SCHEMBL20217342 | 0.86 | APLNR (0.49) | PPARG | |
| SCHEMBL20217138 | 0.86 | ROCK1 (0.52) | KDM4ETAS1R3TAS1R1ROCK2ROCK1 | |
| SCHEMBL20217203 | 0.85 | TAS1R3 (0.59) | TAS1R3TAS1R1ROCK2ROCK1MAPK1 | |
| SCHEMBL20217174 | 0.85 | GRN (0.43) | LMNAKDM4ETAS1R3TAS1R1GRN | |
| SCHEMBL20217148 | 0.85 | GRN (0.43) | LMNAKDM4ETAS1R3TAS1R1GRN | |
| SCHEMBL20217171 | 0.84 | CYP3A4 (0.43) | ALDH1A1PPARGTAS1R3TAS1R1GRN | |
| SCHEMBL20217231 | 0.84 | CYP3A4 (0.43) | ALDH1A1PPARGTAS1R3TAS1R1GRN | |
| SCHEMBL20217634 | 0.78 | TAS1R3 (0.40) | ALDH1A1PPARGKDM4ETAS1R3TAS1R1 | |
| SCHEMBL20217476 | 0.77 | LTB4R (0.35) | ALDH1A1LMNAPPARGTAS1R3TAS1R1 |
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 |