Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 13/20 | 0.41 |
| ▸ | JAK3 | P52333 | 13/20 | 0.41 |
| ▸ | JAK2 | O60674 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 1/20 | 0.36 |
| ▸ | P2RX3 | P56373 | 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 | |
|---|---|---|---|---|
| SCHEMBL31123300 | 1.00 | JAK1 (0.41) | JAK1JAK3JAK2CYP3A4NOS3 | |
| SCHEMBL24865555 | 0.93 | MEN1 (0.39) | — | |
| SCHEMBL31123262 | 0.93 | MEN1 (0.39) | — | |
| SCHEMBL24865673 | 0.87 | JAK1 (0.41) | JAK1JAK3JAK2CYP3A4NOS3 | |
| SCHEMBL31123276 | 0.87 | JAK1 (0.41) | JAK1JAK3JAK2CYP3A4NOS3 | |
| SCHEMBL24865446 | 0.84 | BCL6 (0.39) | JAK2 | |
| SCHEMBL31123302 | 0.84 | BCL6 (0.39) | JAK2 | |
| SCHEMBL24864899 | 0.76 | ADRB1 (0.33) | — | |
| SCHEMBL24865460 | 0.76 | TRPV1 (0.59) | — | |
| SCHEMBL24865324 | 0.76 | TRPV1 (0.50) | — |
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 |