Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 3/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CCR6 | P51684 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.32 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30279117 | 1.00 | CDK2 (0.38) | CDK2IRAK4CHEK1ROCK2MEN1 | |
| SCHEMBL25041354 | 0.81 | ALDH1A1 (0.41) | IRAK4ROCK2PDE3BPDE3ACSNK1D | |
| SCHEMBL25041349 | 0.79 | ROCK2 (0.37) | CDK2ROCK2MAPKAPK2PDE3BPDE3A | |
| SCHEMBL25041352 | 0.79 | ROCK2 (0.49) | IRAK4ROCK2PDE3BPDE3ACSNK1D | |
| SCHEMBL30279151 | 0.73 | CHEK1 (0.38) | CDK2IRAK4CHEK1GSK3BMAPKAPK2 | |
| SCHEMBL25039462 | 0.73 | CHEK1 (0.38) | CDK2IRAK4CHEK1GSK3BMAPKAPK2 | |
| SCHEMBL25040031 | 0.71 | EPHX1 (0.42) | MEN1KMT2AKIF11 | |
| SCHEMBL25040038 | 0.71 | EPHX1 (0.42) | MEN1KMT2AKIF11 | |
| SCHEMBL25039545 | 0.71 | EPHX1 (0.42) | MEN1KMT2AKIF11 | |
| SCHEMBL19194279 | 0.71 | KIF11 (0.39) | MEN1KMT2ACSNK1DCSNK1G2KIF11 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118076581-A | Iron death modulators, their preparation and use | 维泰瑞隆有限公司 | 2024-05-24 | — | — | CN | disclosed |
| WO-2023016447-A1 | FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF | Sironax Ltd. (KY) | 2023-02-16 | — | — | WO | disclosed |