Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 14/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 14/20 | 0.37 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.36 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.31 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.30 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL444954 | 0.94 | HSP90AA1 (0.39) | HSP90AA1HSP90AB1EZH2P2RX3P2RX2 | |
| SCHEMBL12287242 | 0.86 | EZH2 (0.33) | HSP90AA1HSP90AB1EZH2 | |
| SCHEMBL1305321 | 0.84 | EZH2 (0.35) | HSP90AA1HSP90AB1EZH2MAP3K5 | |
| SCHEMBL421350 | 0.82 | KDM4E (0.35) | HSP90AA1HSP90AB1EZH2KDM4EUSP2 | |
| SCHEMBL419119 | 0.80 | KDM4E (0.36) | HSP90AA1HSP90AB1EZH2KDM4EUSP2 | |
| SCHEMBL420062 | 0.78 | KDM4E (0.35) | HSP90AA1HSP90AB1EZH2KDM4EUSP2 | |
| SCHEMBL12180156 | 0.77 | KDM4E (0.37) | HSP90AA1HSP90AB1KDM4EHSD17B10 | |
| SCHEMBL1539292 | 0.75 | HSP90AA1 (0.36) | HSP90AA1HSP90AB1KDM4ETSHRNPSR1 | |
| SCHEMBL12180125 | 0.74 | GOT1 (0.39) | — | |
| SCHEMBL930906 | 0.74 | SLC9A1 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2295416-A2 | Triazole compounds that modulate HSP90 activity | Synta Pharmaceuticals Corp. (US) | 2011-03-16 | — | — | EP | disclosed |