Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAT | P00750 | 3/20 | 0.40 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24946497 | 0.79 | HSP90AA1 (0.32) | HSP90AA1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL29768412 | 0.79 | HSP90AA1 (0.32) | HSP90AA1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL29885871 | 0.79 | HSP90AA1 (0.32) | HSP90AA1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL23239753 | 0.79 | HSP90AA1 (0.32) | HSP90AA1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL23216627 | 0.79 | HSP90AA1 (0.32) | HSP90AA1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL23239859 | 0.79 | HSD17B10 (0.32) | HSP90AA1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL23216901 | 0.79 | HSP90AA1 (0.32) | HSP90AA1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL23215171 | 0.79 | QDPR (0.43) | PLGHSP90AA1CYP3A4HPGDTSHR | |
| SCHEMBL29768382 | 0.79 | QDPR (0.43) | PLGHSP90AA1CYP3A4HPGDTSHR | |
| SCHEMBL24946296 | 0.76 | HTR3A (0.42) | HSP90AA1CYP3A4HPGDTSHRHSD17B10 |
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-2021071802-A1 | ARYL HETEROCYCLIC COMPOUNDS AS KV1.3 POTASSIUM SHAKER CHANNEL BLOCKERS | D. E. SHAW RESEARCH, LLC (US) | 2021-04-15 | — | — | WO | disclosed |