Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 3/20 | 0.32 |
| ▸ | RXRB | P28702 | 2/20 | 0.32 |
| ▸ | RXRG | P48443 | 2/20 | 0.32 |
| ▸ | RARA | P10276 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.31 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.31 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10822546 | 1.00 | HDAC6 (0.38) | HDAC6HDAC4ALDH1A1HPGDAOC3 | |
| SCHEMBL10822331 | 0.89 | HDAC6 (0.36) | HDAC6HDAC4ALDH1A1HPGDAOC3 | |
| SCHEMBL10822422 | 0.89 | HDAC6 (0.36) | HDAC6HDAC4ALDH1A1HPGDAOC3 | |
| SCHEMBL10822682 | 0.87 | HDAC6 (0.44) | HDAC6HDAC4ALDH1A1HPGDAOC3 | |
| SCHEMBL10822691 | 0.87 | HDAC6 (0.44) | HDAC6HDAC4ALDH1A1HPGDAOC3 | |
| SCHEMBL10822583 | 0.86 | PNMT (0.38) | HDAC6HDAC4KMT2AMEN1RXRA | |
| SCHEMBL10822884 | 0.84 | AOC3 (0.43) | HDAC6HDAC4ALDH1A1HPGDAOC3 | |
| SCHEMBL10822878 | 0.84 | AOC3 (0.43) | HDAC6HDAC4ALDH1A1HPGDAOC3 | |
| SCHEMBL9684909 | 0.82 | ABCB1 (0.43) | ALDH1A1LMNA | |
| SCHEMBL9782143 | 0.82 | ALDH1A1 (0.33) | ALDH1A1HPGDRXRARARA |
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-4585796-A | HYPOGLYCEMIC, ANTI-OBESITY | HOFFMANN-LA ROCHE INC. (US) | 1986-04-29 | — | — | US | disclosed |