Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FOLH1 | Q04609 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 12/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HBB | P68871 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 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 | |
|---|---|---|---|---|
| SCHEMBL27739344 | 0.73 | ALDH1A1 (0.44) | FOLH1CYP19A1CYP1A1 | |
| SCHEMBL19941705 | 0.73 | THRB (0.41) | MEN1KMT2AMAPK1HBBHSP90AA1 | |
| SCHEMBL21990274 | 0.72 | FOLH1 (0.36) | FOLH1CYP19A1CYP1A1KMT2A | |
| SCHEMBL28807834 | 0.72 | FOLH1 (0.39) | FOLH1CYP19A1CYP1A1 | |
| SCHEMBL7259407 | 0.69 | CYP19A1 (0.38) | FOLH1CYP19A1 | |
| SCHEMBL29201284 | 0.67 | CYP19A1 (0.48) | FOLH1CYP19A1CYP1A1 | |
| SCHEMBL28468849 | 0.67 | CYP19A1 (0.48) | FOLH1CYP19A1CYP1A1 | |
| SCHEMBL21722399 | 0.67 | CYP19A1 (0.48) | FOLH1CYP19A1CYP1A1 | |
| SCHEMBL9284133 | 0.67 | CYP19A1 (0.58) | CYP19A1CYP1A1KMT2AMAPK1 | |
| SCHEMBL22551813 | 0.66 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2035396-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | Synta Pharmaceuticals Corporation (US) | 2009-03-18 | — | — | EP | disclosed |
| WO-2007139967-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2007-12-06 | — | — | WO | disclosed |