Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 1/20 | 0.36 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30395415 | 0.90 | KDM4E (0.36) | SCDSCD5TYK2ALDH1A1EGLN1 | |
| SCHEMBL25414950 | 0.88 | TYK2 (0.38) | SCDSCD5TYK2ALDH1A1EGLN1 | |
| SCHEMBL30184314 | 0.83 | NPC1 (0.43) | PDPK1ALDH1A1KDM4ETDP1MAP2K1 | |
| SCHEMBL30309818 | 0.73 | KDM4E (0.46) | PDPK1ALDH1A1KDM4ETDP1MAP2K1 | |
| SCHEMBL30410851 | 0.71 | KDR (0.44) | ALDH1A1KDM4EKDRSMN1; SMN2L3MBTL1 | |
| SCHEMBL30309838 | 0.71 | KDR (0.48) | KDR | |
| SCHEMBL25171145 | 0.68 | KDM4E (0.37) | ALDH1A1KDM4ETDP1ALKBH1SMN1; SMN2 | |
| SCHEMBL25414951 | 0.68 | PDE11A (0.36) | PDPK1ALDH1A1KDM4E | |
| SCHEMBL30395140 | 0.68 | KDM4E (0.38) | ALDH1A1KDM4ETDP1KDRSMN1; SMN2 | |
| SCHEMBL30395502 | 0.68 | GPR119 (0.47) | ALDH1A1KDM4ETDP1GPR119L3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023078267-A1 | AMINO-CONTAINING MACROCYCLIC COMPOUND AS PROTEIN KINASE MODULATOR | 赛诺哈勃药业（成都）有限公司 | 2023-05-11 | — | — | WO | disclosed |