Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 18/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12658712 | 1.00 | HSP90AA1 (0.57) | HSP90AA1SMN1; SMN2HSP90AB1HPGDTSHR | |
| SCHEMBL2966316 | 0.80 | HSP90AA1 (0.57) | HSP90AA1 | |
| SCHEMBL15495257 | 0.78 | SMN1; SMN2 (0.46) | HSP90AA1SMN1; SMN2HPGD | |
| SCHEMBL1578295 | 0.77 | HSP90AA1 (0.56) | HSP90AA1SMN1; SMN2HPGDTSHRHSD17B10 | |
| SCHEMBL2726967 | 0.76 | CA12 (0.53) | HSP90AA1SMN1; SMN2HSP90AB1TSHR | |
| SCHEMBL30463099 | 0.76 | CA12 (0.53) | HSP90AA1SMN1; SMN2HSP90AB1TSHR | |
| SCHEMBL23809744 | 0.75 | CSNK2A1 (0.45) | HPGDTSHRHSD17B10 | |
| SCHEMBL15495181 | 0.74 | WDR5 (0.41) | HSP90AA1SMN1; SMN2HPGDTSHRHSD17B10 | |
| SCHEMBL23622342 | 0.74 | LMNA (0.49) | HSP90AA1SMN1; SMN2HSP90AB1HPGDTSHR | |
| SCHEMBL3814303 | 0.74 | P2RX1 (0.53) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-112661661-B | Compounds having HSP90 inhibitory activity or pharmaceutically acceptable salts thereof and medical use thereof | 恩科森株式会社 | 2023-06-27 | — | — | CN | disclosed |