Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24755330 | 1.00 | ALDH1A1 (0.30) | ALDH1A1ALOX15TSHR | |
| SCHEMBL27147798 | 0.81 | MEN1 (0.31) | — | |
| SCHEMBL30065127 | 0.78 | KEAP1 (0.37) | — | |
| SCHEMBL24672358 | 0.78 | KEAP1 (0.37) | — | |
| SCHEMBL29924915 | 0.78 | KEAP1 (0.37) | — | |
| SCHEMBL25988924 | 0.77 | — | — | |
| SCHEMBL24009531 | 0.72 | CYP1A2 (0.42) | ALDH1A1 | |
| SCHEMBL30160371 | 0.72 | CYP1A2 (0.42) | ALDH1A1 | |
| SCHEMBL24342281 | 0.71 | TDP1 (0.37) | — | |
| SCHEMBL29795360 | 0.71 | PDE4A (0.38) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022262686-A1 | KRAS G12D INHIBITORS | JINGRUI BIOPHARMA CO., LTD. (CN) | 2022-12-22 | — | — | WO | disclosed |
| WO-2022171191-A1 | COMPOUNDS AS ANTICANCER AGENTS | JINGRUI BIOPHARMA CO., LTD. (CN) | 2022-08-18 | — | — | WO | disclosed |