Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.55 |
| ▸ | FABP4 | P15090 | 2/20 | 0.52 |
| ▸ | WDR5 | P61964 | 1/20 | 0.52 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.52 |
| ▸ | SLC16A3 | O15427 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | RORA | P35398 | 1/20 | 0.45 |
| ▸ | RORC | P51449 | 1/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.45 |
| ▸ | GHSR | Q92847 | 1/20 | 0.44 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | ITGA1 | P56199 | 1/20 | 0.44 |
| ▸ | CCR8 | P51685 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6206726 | 1.00 | TSHR (0.57) | TSHRALDH1A1HTTPFKFB3FABP4 | |
| SCHEMBL6206539 | 1.00 | TSHR (0.57) | TSHRALDH1A1HTTPFKFB3FABP4 | |
| SCHEMBL6207661 | 0.84 | SLC22A12 (0.51) | FABP4WDR5FABP5ITGA1 | |
| SCHEMBL6207659 | 0.84 | SLC22A12 (0.51) | FABP4WDR5FABP5ITGA1 | |
| SCHEMBL6205432 | 0.84 | SLC22A12 (0.51) | FABP4WDR5FABP5ITGA1 | |
| SCHEMBL6205307 | 0.81 | WDR5 (0.54) | ALDH1A1FABP4WDR5FABP5PGR | |
| SCHEMBL6204568 | 0.81 | AKR1C3 (0.61) | ALDH1A1PFKFB3SLC16A3PGRMAPT | |
| SCHEMBL6204562 | 0.81 | AKR1C3 (0.61) | ALDH1A1PFKFB3SLC16A3PGRMAPT | |
| SCHEMBL6205309 | 0.81 | WDR5 (0.54) | ALDH1A1FABP4WDR5FABP5PGR | |
| SCHEMBL6205304 | 0.81 | WDR5 (0.54) | ALDH1A1FABP4WDR5FABP5PGR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1100763-B1 | DIKETOACID-DERIVATIVES AS INHIBITORS OF POLYMERASES | ANGELETTI P IST RICHERCHE BIO (IT) | 2005-06-22 | — | — | EP | claimed |