Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 18/20 | 0.40 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 13/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17949125 | 0.92 | SMPD1 (0.40) | HSP90AB1HSP90AA1 | |
| SCHEMBL17948694 | 0.91 | TP53 (0.36) | HSP90AB1TRAP1HSP90AA1 | |
| SCHEMBL17948588 | 0.91 | CNR2 (0.38) | — | |
| SCHEMBL17948606 | 0.91 | RAB9A (0.39) | HSP90AA1 | |
| SCHEMBL17948591 | 0.91 | CNR2 (0.38) | HSP90AB1TRAP1 | |
| SCHEMBL17948586 | 0.88 | RXRA (0.39) | — | |
| SCHEMBL17948653 | 0.87 | CNR2 (0.35) | HSP90AB1HSP90AA1 | |
| SCHEMBL17948604 | 0.87 | CNR2 (0.35) | — | |
| SCHEMBL19638280 | 0.85 | HSP90AB1 (0.41) | HSP90AB1TRAP1HSP90AA1 | |
| SCHEMBL11994126 | 0.84 | HSP90AB1 (0.46) | HSP90AB1TRAP1HSP90AA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3248968-A1 | RESORCINOL DERIVATIVE AS HSP90 INHIBITOR | Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) | 2017-11-29 | — | — | EP | disclosed |
| WO-2016116061-A1 | RESORCINOL DERIVATIVE AS HSP90 INHIBITOR | 南京明德新药研发股份有限公司 | 2016-07-28 | — | — | WO | disclosed |