Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | PKN1 | Q16512 | 2/20 | 0.35 |
| ▸ | PKN2 | Q16513 | 2/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 1/20 | 0.34 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.34 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.34 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20917255 | 1.00 | RAF1 (0.41) | RAF1ALDH1A1ATMPKN1PKN2 | |
| SCHEMBL22361080 | 0.90 | PIN1 (0.36) | RAF1ALDH1A1PKN1PKN2MAPK14 | |
| SCHEMBL22284224 | 0.90 | PDE10A (0.37) | ALDH1A1MAPK1MAPK14KDM4EPDE10A | |
| SCHEMBL22284329 | 0.90 | PDE10A (0.40) | MAPK1PDE10A | |
| SCHEMBL20920120 | 0.89 | MAPK1 (0.35) | ALDH1A1MAPK1MEN1KMT2AMAPT | |
| SCHEMBL22284293 | 0.85 | GSK3B (0.35) | ALDH1A1MAPK1MAPTKDM4EPOLB | |
| SCHEMBL22284160 | 0.85 | TACR3 (0.34) | RAF1ALDH1A1MAPK1MAPTKDM4E | |
| SCHEMBL22284303 | 0.85 | ROCK2 (0.42) | ALDH1A1PKN2MAPK1MEN1KMT2A | |
| SCHEMBL22284300 | 0.85 | ROCK2 (0.42) | ALDH1A1PKN2MAPK1MEN1KMT2A | |
| SCHEMBL30554287 | 0.85 | ROCK2 (0.42) | ALDH1A1PKN2MAPK1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-112020357-B | Salt of indazolyl-containing tricyclic derivative and crystal form thereof | 上海翰森生物医药科技有限公司 | 2023-08-29 | — | — | CN | disclosed |