Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 13/20 | 0.87 |
| ▸ | HSP90AB1 | P08238 | 13/20 | 0.87 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL2428577 | 0.94 | HSP90AA1 (0.76) | HSP90AA1HSP90AB1NPC1ALDH1A1MAPT | |
| SCHEMBL2428574 | 0.94 | HSP90AA1 (0.76) | HSP90AA1HSP90AB1NPC1ALDH1A1MAPT | |
| SCHEMBL3979059 | 0.93 | HSP90AA1 (0.75) | HSP90AA1HSP90AB1NPC1ALDH1A1MAPT | |
| SCHEMBL2429436 | 0.93 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL2429433 | 0.93 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL2429266 | 0.92 | HSP90AA1 (0.77) | HSP90AA1HSP90AB1NPC1ALDH1A1MAPT | |
| SCHEMBL2429263 | 0.92 | HSP90AA1 (0.77) | HSP90AA1HSP90AB1NPC1ALDH1A1MAPT | |
| SCHEMBL3977441 | 0.92 | HSP90AA1 (0.77) | HSP90AA1HSP90AB1RAB9A | |
| SCHEMBL2426780 | 0.92 | HSP90AA1 (0.75) | HSP90AA1HSP90AB1MAPTLMNATP53 | |
| SCHEMBL2426782 | 0.92 | HSP90AA1 (0.75) | HSP90AA1HSP90AB1MAPTLMNATP53 |
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-2074120-A1 | TROPANE COMPOUNDS | Exelixis, Inc. (US) | 2009-07-01 | — | — | EP | disclosed |
| WO-2009055077-A1 | TROPANE COMPOUNDS | EXELIXIS, INC. (US) | 2009-04-30 | — | — | WO | disclosed |