Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 12/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 7/20 | 0.53 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL16582202 | 1.00 | HSP90AB1 (0.53) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL16569693 | 0.99 | HSP90AB1 (0.52) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A | |
| SCHEMBL25216919 | 0.93 | HSP90AB1 (0.58) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A | |
| SCHEMBL384471 | 0.91 | HSP90AB1 (0.64) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A | |
| SCHEMBL31363033 | 0.90 | HSP90AB1 (0.55) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A | |
| SCHEMBL25317220 | 0.89 | HSP90AB1 (0.54) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A | |
| SCHEMBL25260723 | 0.88 | HSP90AA1 (0.54) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A | |
| SCHEMBL31108384 | 0.88 | HSP90AA1 (0.51) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A | |
| SCHEMBL25271350 | 0.88 | HSP90AA1 (0.51) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A | |
| SCHEMBL25317145 | 0.87 | HSP90AA1 (0.52) | HSP90AB1HSP90AA1HSP90B1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-119100970-A | Bivalent inhibitor based on heat shock protein 90 and preparation method and application thereof | 中国药科大学 | 2024-12-10 | — | — | CN | claimed |
| CN-119100970-A | Bivalent inhibitor based on heat shock protein 90 and preparation method and application thereof | 中国药科大学 | 2024-12-10 | — | — | CN | disclosed |
| WO-2024034591-A1 | HETEROCYCLIC COMPOUND FOR INHIBITING AND/OR INDUCING DEGRADATION OF KRAS PROTEIN | アステラス製薬株式会社 | 2024-02-15 | — | — | WO | disclosed |