Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 3/20 | 0.49 |
| ▸ | METTL3 | Q86U44 | 3/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.38 |
| ▸ | KLK1 | P06870 | 2/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | TYK2 | P29597 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | CSK | P41240 | 1/20 | 0.37 |
| ▸ | ABL2 | P42684 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | AHCY | P23526 | 1/20 | 0.37 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25883660 | 1.00 | KLKB1 (0.49) | KLKB1METTL3RIPK1KLK1JAK2 | |
| SCHEMBL26584271 | 0.85 | XDH (0.41) | KLKB1METTL3KLK1ROCK1MAPK14 | |
| SCHEMBL25883694 | 0.84 | SMN1; SMN2 (0.48) | METTL3RIPK1MMP13 | |
| SCHEMBL25884663 | 0.80 | SCD (0.43) | KLKB1METTL3RIPK1KLK1ABL1 | |
| SCHEMBL25310332 | 0.79 | KLKB1 (0.52) | KLKB1METTL3RIPK1 | |
| SCHEMBL30504872 | 0.79 | KLKB1 (0.52) | KLKB1METTL3RIPK1 | |
| SCHEMBL29484997 | 0.79 | NR3C1 (0.46) | KLKB1METTL3KLK1JAK2JAK1 | |
| SCHEMBL25309990 | 0.79 | NR3C1 (0.46) | KLKB1METTL3KLK1JAK2JAK1 | |
| SCHEMBL25312468 | 0.78 | MKNK2 (0.46) | METTL3ABL1EGFRCDK1SRC | |
| SCHEMBL29484999 | 0.77 | MMP13 (0.43) | KLKB1METTL3RIPK1KLK1ABL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4215532-A1 | PROGRAMMED CELL NECROSIS INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) | 2023-07-26 | — | — | EP | disclosed |
| WO-2022057787-A1 | PROGRAMMED CELL NECROSIS INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 中国科学院上海有机化学研究所 | 2022-03-24 | — | — | WO | disclosed |