Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.33 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24328335 | 0.74 | HCRTR2 (0.35) | RPS6KA5RPS6KA4HCRTR2ROCK1 | |
| SCHEMBL24327450 | 0.74 | ABL1 (0.31) | RPS6KA5RPS6KA4SMN1; SMN2 | |
| SCHEMBL24328339 | 0.74 | SMN1; SMN2 (0.33) | SMN1; SMN2 | |
| SCHEMBL30919743 | 0.74 | ROCK1 (0.49) | ALDH1A1MAPK1L3MBTL1LMNAMAPT | |
| SCHEMBL24327018 | 0.73 | HTR2A (0.43) | ALDH1A1MAPK1L3MBTL1RPS6KA5RPS6KA4 | |
| SCHEMBL24328599 | 0.71 | RPS6KB1 (0.35) | MAPK1LMNAMAPT | |
| SCHEMBL24327036 | 0.70 | CDK1 (0.39) | — | |
| SCHEMBL24351534 | 0.70 | NUDT1 (0.35) | — | |
| SCHEMBL29651265 | 0.68 | NPC1 (0.53) | ALDH1A1MAPK1LMNAMAPTROCK1 | |
| SCHEMBL25499920 | 0.68 | NPC1 (0.53) | ALDH1A1MAPK1LMNAMAPTROCK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022063106-A1 | INDOLINE COMPOUNDS AND DERIVATIVES AS EGFR INHIBITORS | BEIGENE, LTD. (KY) | 2022-03-31 | — | — | WO | disclosed |