Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 14/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.49 |
| ▸ | GAA | P10253 | 9/20 | 0.49 |
| ▸ | HPGD | P15428 | 7/20 | 0.49 |
| ▸ | GLA | P06280 | 6/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | CASP1 | P29466 | 3/20 | 0.49 |
| ▸ | CASP7 | P55210 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 5/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6593039 | 0.87 | KDM4E (0.53) | MAPTKDM4EALDH1A1GAAHPGD | |
| SCHEMBL8329505 | 0.83 | MAPT (0.57) | MAPTKDM4EALDH1A1GAAHPGD | |
| SCHEMBL5737372 | 0.79 | AKR1B1 (0.42) | — | |
| SCHEMBL8332827 | 0.78 | GRM5 (0.35) | KMT2A | |
| SCHEMBL6591390 | 0.76 | MAPT (0.57) | MAPTKDM4EALDH1A1GAAHPGD | |
| SCHEMBL6591837 | 0.74 | MAPT (0.61) | MAPTKDM4EALDH1A1GAAHPGD | |
| SCHEMBL7269382 | 0.74 | MAPT (0.61) | MAPTKDM4EALDH1A1GAAHPGD | |
| SCHEMBL6591210 | 0.74 | ALDH1A1 (0.56) | MAPTKDM4EALDH1A1GAAHPGD | |
| SCHEMBL6592120 | 0.74 | RARA (0.52) | — | |
| SCHEMBL3353464 | 0.73 | MAPT (0.68) | MAPTKDM4EALDH1A1GAAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5958954-A | 2,2-DIALKYL-4-ARYL-SUBSTITUTED BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES | ALLERGAN SALES, INC. (US) | 1999-09-28 | — | — | US | disclosed |