Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.55 |
| ▸ | HTR6 | P50406 | 1/20 | 0.55 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.53 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.53 |
| ▸ | TYR | P14679 | 1/20 | 0.51 |
| ▸ | IDH1 | O75874 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16719591 | 0.79 | ESR1 (0.62) | ESR1CYP19A1HTR6TYRIDH1 | |
| SCHEMBL4884802 | 0.76 | ESR1 (0.70) | ESR1CYP19A1HTR6HDAC1HDAC8 | |
| SCHEMBL16719331 | 0.76 | ESR1 (0.78) | ESR1CYP19A1HTR6IDH1ALDH1A1 | |
| SCHEMBL19329420 | 0.74 | ESR1 (0.53) | ESR1CYP19A1HTR6IDH1ALDH1A1 | |
| SCHEMBL16719422 | 0.74 | ESR1 (0.59) | ESR1CYP19A1HTR6TYRIDH1 | |
| SCHEMBL5820194 | 0.73 | ESR1 (0.74) | ESR1CYP19A1HTR6GAAALDH1A1 | |
| Sulfuric Acid SCHEMBL23541029 | 0.73 | TYR (0.81) | ESR1CYP19A1HTR6TYRGAA | |
| Sulfuric Acid SCHEMBL29374819 | 0.73 | TYR (0.81) | ESR1CYP19A1HTR6TYRGAA | |
| SCHEMBL31701332 | 0.73 | ESR1 (0.61) | ESR1CYP19A1HTR6IDH1ALDH1A1 | |
| SCHEMBL1607103 | 0.72 | PIP4K2A (0.64) | ESR1CYP19A1HTR6HDAC3HDAC4 |
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-2005090298-A1 | SULPHONAMIDE DERIVATIVES | BIOTIE THERAPIES CORPORATION (FI) | 2005-09-29 | — | — | WO | disclosed |