Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K11 | Q16584 | 5/20 | 0.37 |
| ▸ | GUSB | P08236 | 5/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.34 |
| ▸ | GABRE | P78334 | 1/20 | 0.34 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.34 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.34 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.34 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 5/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL421210 | 0.83 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| SCHEMBL12694836 | 0.77 | MAP3K11 (0.39) | MAP3K11GUSBGABRPGABRDGABRA1 | |
| SCHEMBL4083284 | 0.75 | HSP90AA1 (0.36) | HSP90AA1HSP90AB1 | |
| SCHEMBL20879033 | 0.72 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1 | |
| SCHEMBL3989106 | 0.69 | HSP90AA1 (0.55) | HSP90AA1HSP90AB1 | |
| SCHEMBL15940182 | 0.69 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| SCHEMBL1861797 | 0.68 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1 | |
| SCHEMBL14342490 | 0.66 | HSP90AA1 (0.69) | HSP90AA1HSP90AB1 | |
| SCHEMBL3915279 | 0.66 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1 | |
| SCHEMBL3094973 | 0.66 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1 |
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-2054059-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | Synta Pharmaceuticals Corporation (US) | 2009-05-06 | — | — | EP | disclosed |
| WO-2008021364-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2008-02-21 | — | — | WO | disclosed |