Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.50 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.50 |
| ▸ | HKDC1 | Q2TB90 | 2/20 | 0.45 |
| ▸ | TDP2 | O95551 | 1/20 | 0.45 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 8/20 | 0.43 |
| ▸ | HTT | P42858 | 8/20 | 0.43 |
| ▸ | RAB9A | P51151 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.43 |
| ▸ | ATM | Q13315 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6240578 | 0.93 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 | |
| SCHEMBL6244227 | 0.76 | MAOA (0.48) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 | |
| SCHEMBL6239508 | 0.75 | TDP2 (0.48) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 | |
| SCHEMBL6240574 | 0.74 | TDP2 (0.55) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 | |
| SCHEMBL16297179 | 0.70 | MAPT (0.61) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 | |
| SCHEMBL134428 | 0.70 | HSP90AA1 (0.68) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 | |
| SCHEMBL31162649 | 0.70 | HSP90AA1 (0.68) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 | |
| SCHEMBL6240247 | 0.69 | MAOA (0.49) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 | |
| SCHEMBL6190569 | 0.68 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 | |
| SCHEMBL31087717 | 0.68 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1HKDC1TDP2PAX8 |
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-2005016264-A2 | DIAMINE DERIVATIVES OF QUINONE AND USES THEREOF | AVALON PHARMACEUTICALS (US) | 2005-02-24 | — | — | WO | disclosed |