Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GCGR | P47871 | 2/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.30 |
| ▸ | CD274 | Q9NZQ7 | 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 | |
|---|---|---|---|---|
| SCHEMBL29083581 | 0.87 | PDCD1 (0.35) | GABRA1GABRG2GABRB3PDCD1CD274 | |
| SCHEMBL29126117 | 0.79 | CDK1 (0.35) | GABRA1GABRG2GABRB3 | |
| SCHEMBL29126122 | 0.73 | ESR1 (0.35) | — | |
| SCHEMBL29083603 | 0.68 | GCGR (0.41) | GCGRPDCD1CD274 | |
| SCHEMBL19393368 | 0.66 | ACHE (0.38) | — | |
| SCHEMBL30539359 | 0.66 | GABRA1 (0.34) | GABRA1GABRG2GABRB3 | |
| SCHEMBL30539356 | 0.66 | GABRA1 (0.34) | GABRA1GABRG2GABRB3 | |
| SCHEMBL1582351 | 0.64 | MEN1 (0.39) | — | |
| SCHEMBL5838621 | 0.63 | TDP1 (0.39) | — | |
| SCHEMBL6678983 | 0.63 | TAAR1 (0.43) | — |
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-116813666-A | Phosphine ligand compound with benzyl alcohol group and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-09-29 | — | — | CN | disclosed |
| CN-116813451-A | Substituted benzyl alcohol compound and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-09-29 | — | — | CN | disclosed |