Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SCN4A | P35499 | 9/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.33 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SCN1A | P35498 | 2/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.33 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.33 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL22325961 | 0.85 | ALDH1A1 (0.41) | CD44HSP90AA1ALDH1A1CYP3A4TSHR | |
| SCHEMBL22326003 | 0.77 | ALDH1A1 (0.46) | HSP90AA1ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL22325979 | 0.74 | MAOA (0.42) | ALDH1A1CYP3A4TSHRTDP1CYP1A2 | |
| SCHEMBL437049 | 0.73 | HSP90AA1 (0.50) | CD44HSP90AA1ALDH1A1SCN4ACYP3A4 | |
| SCHEMBL1519286 | 0.72 | ALOX5AP (0.40) | ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL24048197 | 0.71 | HSP90AA1 (0.38) | CD44HSP90AA1ALDH1A1SCN4ACYP3A4 | |
| Phosphine SCHEMBL21753753 | 0.71 | HSP90AA1 (0.48) | CD44HSP90AA1ALDH1A1SCN4ACYP3A4 | |
| SCHEMBL22511338 | 0.70 | AR (0.45) | CD44HSP90AA1ALDH1A1CYP3A4TSHR | |
| SCHEMBL22325783 | 0.70 | L3MBTL1 (0.40) | HSP90AA1ALDH1A1CYP3A4LMNASCN5A | |
| SCHEMBL22325738 | 0.68 | MAOA (0.47) | ALDH1A1CYP3A4TSHRTDP1SCN9A |
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-2020162471-A1 | PYRIDONE DERIVATIVE | マルホ株式会社 | 2020-08-13 | — | — | WO | disclosed |