Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 13/20 | 0.92 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.74 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3958250 | 0.96 | HSP90AB1 (1.00) | HSP90AB1HSP90AA1KCNH2 | |
| SCHEMBL4188601 | 0.91 | HSP90AB1 (0.81) | HSP90AB1HSP90AA1KCNH2 | |
| SCHEMBL3957638 | 0.90 | HSP90AB1 (0.89) | HSP90AB1HSP90AA1KCNH2 | |
| SCHEMBL3962983 | 0.89 | HSP90AB1 (0.74) | HSP90AB1HSP90AA1KCNH2LMNA | |
| SCHEMBL3956199 | 0.88 | HSP90AB1 (1.00) | HSP90AB1HSP90AA1KCNH2 | |
| SCHEMBL13905719 | 0.86 | HSP90AA1 (0.90) | HSP90AB1HSP90AA1KCNH2 | |
| SCHEMBL3955711 | 0.85 | HSP90AB1 (0.80) | HSP90AB1HSP90AA1KCNH2 | |
| SCHEMBL3956737 | 0.85 | HSP90AB1 (0.89) | HSP90AB1HSP90AA1KCNH2 | |
| SCHEMBL3950788 | 0.85 | HSP90AA1 (1.00) | HSP90AB1HSP90AA1KCNH2 | |
| SCHEMBL3958501 | 0.85 | HSP90AB1 (0.74) | HSP90AB1HSP90AA1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009030871-A1 | PYRROLOPYRIMIDINE DERIVATIVES HAVING HSP90 INHIBITORY ACTIVITY | VERNALIS R & D LTD (GB) | 2009-03-12 | — | — | WO | claimed |
| WO-2009030871-A1 | PYRROLOPYRIMIDINE DERIVATIVES HAVING HSP90 INHIBITORY ACTIVITY | VERNALIS R & D LTD (GB) | 2009-03-12 | — | — | WO | disclosed |
| WO-2009030871-A1 | PYRROLOPYRIMIDINE DERIVATIVES HAVING HSP90 INHIBITORY ACTIVITY | VERNALIS R & D LTD (GB) | 2009-03-12 | — | — | WO | disclosed |