Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30336656 | 1.00 | ALDH1A1 (0.44) | ALDH1A1POLBPIK3CGCHRM5CHRM1 | |
| SCHEMBL24864939 | 0.88 | ALDH1A1 (0.47) | ALDH1A1POLBPIK3CGCHRM5CHRM1 | |
| SCHEMBL30336220 | 0.88 | ALDH1A1 (0.47) | ALDH1A1POLBPIK3CGCHRM5CHRM1 | |
| SCHEMBL29209064 | 0.85 | ALDH1A1 (0.46) | ALDH1A1POLBPIK3CGL3MBTL1RORC | |
| SCHEMBL24865349 | 0.83 | GABRG2 (0.46) | ALDH1A1POLBGABRG2GABRB3GABRA5 | |
| SCHEMBL30336271 | 0.83 | GABRG2 (0.46) | ALDH1A1POLBGABRG2GABRB3GABRA5 | |
| SCHEMBL24865351 | 0.80 | MAPT (0.41) | CHRM5CHRM1CHRM3GABRG2GABRB3 | |
| SCHEMBL30336252 | 0.80 | GABRG2 (0.35) | POLBCHRM5CHRM1CHRM3GABRG2 | |
| SCHEMBL24865447 | 0.80 | GABRG2 (0.35) | POLBCHRM5CHRM1CHRM3GABRG2 | |
| SCHEMBL31123245 | 0.79 | ALDH1A1 (0.42) | ALDH1A1POLBPIK3CGL3MBTL1LMNA |
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-117999259-A | Iron death modulators, their preparation and use | 维泰瑞隆有限公司 | 2024-05-07 | — | — | CN | disclosed |
| WO-2023280296-A1 | FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF | Sironax Ltd. (KY) | 2023-01-12 | — | — | WO | disclosed |