Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | IDH1 | O75874 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 4/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | MET | P08581 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | TEK | Q02763 | 1/20 | 0.32 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8930317 | 0.87 | GAA (0.42) | HSP90AA1HSP90AB1IDH1MAPTKDM4E | |
| SCHEMBL14286453 | 0.86 | MEN1 (0.40) | HSP90AA1HSP90AB1MAPTGAAMGAM | |
| SCHEMBL930819 | 0.84 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1IDO1IDH1MAPT | |
| SCHEMBL977297 | 0.82 | IDH1 (0.38) | HSP90AA1HSP90AB1IDH1GAAMTNR1B | |
| SCHEMBL930543 | 0.79 | GAA (0.42) | HSP90AA1HSP90AB1IDH1MAPTKDM4E | |
| SCHEMBL931820 | 0.79 | GAA (0.38) | HSP90AA1HSP90AB1IDH1MAPTKDM4E | |
| SCHEMBL8930321 | 0.77 | HSP90AA1 (0.38) | HSP90AA1HSP90AB1MAPTKDM4EPOLB | |
| SCHEMBL8930333 | 0.77 | HSP90AA1 (0.44) | HSP90AA1HSP90AB1MAPTGAAMEN1 | |
| SCHEMBL930137 | 0.75 | MAPT (0.41) | HSP90AA1HSP90AB1MAPTKDM4EPOLB | |
| SCHEMBL8930323 | 0.75 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1MAPTKDM4EGAA |
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-2008021364-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2008-02-21 | — | — | WO | disclosed |