Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 6/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 7/20 | 0.31 |
| ▸ | HTR4 | Q13639 | 7/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL1148514 | 0.81 | HCRTR1 (0.37) | GAA | |
| SCHEMBL1342905 | 0.80 | CCNB2 (0.36) | GAA | |
| SCHEMBL1344647 | 0.73 | NR1I2 (0.32) | — | |
| SCHEMBL1344644 | 0.72 | KIF11 (0.39) | — | |
| SCHEMBL2596697 | 0.72 | MGAM (0.34) | PARP1MGAMGAASIMGAM2 | |
| SCHEMBL1148440 | 0.69 | ALDH1A1 (0.37) | GAA | |
| SCHEMBL1148557 | 0.67 | PDE4D (0.37) | — | |
| SCHEMBL1148837 | 0.66 | ALDH1A1 (0.36) | — | |
| SCHEMBL1344291 | 0.65 | NR1I2 (0.41) | GAA | |
| SCHEMBL1148817 | 0.63 | ALDH1A1 (0.39) | L3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1817295-A1 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | Synta Pharmaceuticals Corporation (US) | 2007-08-15 | — | — | EP | claimed |
| WO-2006055760-A9 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP (US) | 2006-09-21 | — | — | WO | claimed |
| WO-2006055760-A1 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2006-05-26 | — | — | WO | claimed |