Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 11/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL14106636 | 0.91 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1HDAC3HDAC1HDAC8 | |
| SCHEMBL14104704 | 0.75 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1 | |
| SCHEMBL13833713 | 0.74 | HSP90AA1 (0.42) | HSP90AA1HSP90AB1 | |
| SCHEMBL14043903 | 0.73 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1RAB9AALDH1A1MAPT | |
| SCHEMBL16116988 | 0.69 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1 | |
| SCHEMBL12634463 | 0.69 | HSP90AA1 (0.49) | HSP90AA1HSP90AB1 | |
| SCHEMBL19154130 | 0.67 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1USP2HDAC3HDAC1 | |
| SCHEMBL15000795 | 0.67 | HSP90AA1 (0.68) | HSP90AA1HSP90AB1SMN1; SMN2 | |
| SCHEMBL21644674 | 0.66 | HSP90AA1 (0.59) | HSP90AA1HSP90AB1HDAC3HDAC1HDAC8 | |
| SCHEMBL20509051 | 0.65 | HSP90AA1 (0.55) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008103353-A1 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2008-08-28 | — | — | WO | disclosed |