Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPY1R | P25929 | 1/20 | 0.37 |
| ▸ | NPY2R | P49146 | 1/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PAK4 | O96013 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| SCHEMBL2944987 | 0.84 | SMN1; SMN2 (0.40) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 | |
| SCHEMBL3395215 | 0.83 | NOTUM (0.48) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 | |
| SCHEMBL3462916 | 0.82 | MAPT (0.43) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 | |
| SCHEMBL21054608 | 0.79 | L3MBTL1 (0.44) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 | |
| Formic Acid SCHEMBL30025828 | 0.78 | MAP4K4 (0.39) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 | |
| Formic Acid SCHEMBL21054834 | 0.78 | MAP4K4 (0.39) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 | |
| SCHEMBL23788247 | 0.75 | HPGD (0.37) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 | |
| SCHEMBL23788253 | 0.73 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 | |
| SCHEMBL21054537 | 0.72 | ALDH1A1 (0.44) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 | |
| SCHEMBL30025873 | 0.72 | ALDH1A1 (0.44) | SMN1; SMN2ALDH1A1RAB9ATDP1L3MBTL1 |
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-111698989-B | Heterocyclic substituted pyridine derivatives as antifungal agents | 安普利克斯制药公司 | 2023-08-01 | — | — | CN | disclosed |
| CN-111698989-A | Heterocyclic substituted pyridine derivative antifungal agent | 安普利克斯制药公司 | 2020-09-22 | — | — | CN | disclosed |