Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL15317700 | 0.89 | MAPT (0.57) | RPS6KA2MAPK1NPC1RAB9AMAPT | |
| SCHEMBL3258508 | 0.83 | RPS6KA2 (0.48) | RPS6KA2RAB9ATP53CYP2C19LMNA | |
| SCHEMBL10195016 | 0.76 | TAS2R8 (0.53) | RPS6KA2NPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL14409565 | 0.75 | RAB9A (0.79) | MAPK1NPC1RAB9ATP53PKM | |
| SCHEMBL8178868 | 0.75 | TAS2R8 (0.43) | RPS6KA2MAPK1KDRIKBKETBK1 | |
| SCHEMBL763452 | 0.74 | HTT (0.78) | MAPK1CYP2C19LMNAHTTSMN1; SMN2 | |
| SCHEMBL280240 | 0.74 | MEN1 (0.76) | MAPK1CYP2C19LMNAHTTALDH1A1 | |
| SCHEMBL15214859 | 0.74 | MAP4K4 (0.50) | MAPK1NPC1RAB9ALMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL3257525 | 0.73 | TAS2R8 (0.43) | RPS6KA2MAPK1KDRIKBKETBK1 | |
| SCHEMBL6937374 | 0.73 | JAK2 (0.41) | MAPK1RAB9AMAPTLMNA |
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-2655357-B1 | INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS | MERCK SERONO SA (CH) | 2016-06-22 | — | — | EP | disclosed |