Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 3/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.38 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2426799 | 0.83 | HCAR3 (0.55) | HCAR3CREBBPHSP90AA1 | |
| SCHEMBL2422533 | 0.80 | HSP90AA1 (0.53) | HCAR3HSP90B1HSP90AA1 | |
| SCHEMBL2422536 | 0.80 | HSP90AA1 (0.53) | HCAR3HSP90B1HSP90AA1 | |
| SCHEMBL2426534 | 0.80 | HCAR3 (0.57) | HCAR3CREBBP | |
| SCHEMBL2426793 | 0.80 | HCAR3 (0.57) | HCAR3CREBBP | |
| SCHEMBL2424448 | 0.79 | HCAR3 (0.56) | HCAR3CREBBP | |
| SCHEMBL12294374 | 0.78 | CREBBP (0.43) | HCAR3CREBBPHSP90AA1BTK | |
| SCHEMBL2425142 | 0.78 | JAK2 (0.49) | HCAR3CREBBPBTK | |
| SCHEMBL2427377 | 0.77 | CREBBP (0.51) | HCAR3CREBBPKCNH2HSP90AA1 | |
| SCHEMBL13885493 | 0.76 | CREBBP (0.40) | HCAR3CREBBPHSP90AA1BTK |
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 |
|---|---|---|---|---|---|---|---|
| CN-101910168-B | Tropane compounds | EXELIXIS INC | 2014-07-30 | — | — | CN | disclosed |
| CN-101910168-A | Tropane compounds | EXELIXIS INC | 2010-12-08 | — | — | CN | disclosed |