Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL29083615 | 0.80 | PTGS2 (0.32) | PTGS2HSPA5MEN1GAAKMT2A | |
| SCHEMBL12895703 | 0.77 | TDP1 (0.41) | PTGS2HSPA5MEN1GAAKMT2A | |
| SCHEMBL509442 | 0.76 | HSPA5 (0.35) | AKT1PTGS2HSPA5MEN1GAA | |
| SCHEMBL1760666 | 0.73 | DHFR (0.44) | PTGS2HSPA5MEN1GAAKMT2A | |
| SCHEMBL9517687 | 0.72 | SRC (0.34) | PTGS2HSPA5MEN1GAAKMT2A | |
| SCHEMBL9517681 | 0.72 | PTGS2 (0.32) | PTGS2HSPA5MEN1GAAKMT2A | |
| SCHEMBL27214784 | 0.69 | NQO1 (0.42) | HSPA5MEN1GAAKMT2A | |
| SCHEMBL18242007 | 0.69 | HSPA5 (0.36) | PTGS2HSPA5MEN1GAAKMT2A | |
| SCHEMBL8734181 | 0.67 | HSPA5 (0.35) | AKT1PTGS2HSPA5MEN1GAA | |
| SCHEMBL18378504 | 0.67 | HSPA5 (0.35) | PTGS2HSPA5MEN1GAAKMT2A |
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 3 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 | claimed |
| 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 |