Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 3/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9501203 | 1.00 | TSHR (0.58) | TSHRMAPK1PDE7AALDH1A1GAA | |
| SCHEMBL24347083 | 0.86 | TSHR (0.55) | TSHRMAPK1PDE7AALDH1A1GAA | |
| SCHEMBL16959232 | 0.86 | TSHR (0.55) | TSHRMAPK1PDE7AALDH1A1GAA | |
| SCHEMBL31387227 | 0.85 | TSHR (0.58) | TSHRMAPK1PDE7AALDH1A1GAA | |
| SCHEMBL9886771 | 0.85 | VCAM1 (0.55) | MAPK1ALDH1A1HPGDVCAM1TDP1 | |
| SCHEMBL4547845 | 0.82 | TSHR (0.55) | TSHRMAPK1ALDH1A1VCAM1TDP1 | |
| SCHEMBL2942137 | 0.82 | TSHR (0.50) | TSHRMAPK1ALDH1A1GAAHPGD | |
| SCHEMBL2942139 | 0.82 | TSHR (0.50) | TSHRMAPK1ALDH1A1GAAHPGD | |
| SCHEMBL10910506 | 0.82 | TSHR (0.50) | TSHRMAPK1PDE7AALDH1A1GAA | |
| SCHEMBL6234170 | 0.79 | PDK1 (0.44) | TSHRMAPK1ALDH1A1VCAM1TDP1 |
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-4543863-A1 | FERROPTOSIS INHIBITORS AND USES THEREOF | University Of Ottawa (CA) | 2025-04-30 | — | — | EP | disclosed |
| WO-2023245297-A1 | FERROPTOSIS INHIBITORS AND USES THEREOF | UNIVERSITY OF OTTAWA (CA) | 2023-12-28 | — | — | WO | disclosed |