Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 3/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.35 |
| ▸ | ASPH | Q12797 | 1/20 | 0.35 |
| ▸ | SORT1 | Q99523 | 3/20 | 0.34 |
| ▸ | TAS2R14 | Q9NYV8 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2427452 | 1.00 | HCAR3 (0.37) | HCAR3AKR1C3AKR1C2HSP90AA1HSP90AB1 | |
| SCHEMBL2421470 | 0.90 | POLB (0.39) | HCAR3AKR1C3AKR1C2HSP90AA1HSP90AB1 | |
| SCHEMBL2423686 | 0.89 | CFTR (0.40) | HSP90AA1HSP90AB1MAPK8MAPK10KDM4E | |
| SCHEMBL2423689 | 0.89 | CFTR (0.40) | HSP90AA1HSP90AB1MAPK8MAPK10KDM4E | |
| SCHEMBL2427839 | 0.87 | KDM4E (0.38) | HSP90AA1HSP90AB1MAPK8MAPK10KDM4E | |
| SCHEMBL2424139 | 0.81 | HSP90AA1 (0.46) | HCAR3HSP90AA1HSP90AB1POLBMAPK1 | |
| SCHEMBL29460660 | 0.81 | HSP90AA1 (0.46) | HCAR3HSP90AA1HSP90AB1POLBMAPK1 | |
| SCHEMBL2428783 | 0.81 | HCAR3 (0.40) | HCAR3HSP90AA1HSP90AB1POLBMAPK1 | |
| SCHEMBL2424142 | 0.81 | HSP90AA1 (0.46) | HCAR3HSP90AA1HSP90AB1POLBMAPK1 | |
| SCHEMBL2426568 | 0.81 | HSP90AA1 (0.46) | HCAR3HSP90AA1HSP90AB1POLBMAPK1 |
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 5 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 |
| EP-2074120-B1 | TROPANE COMPOUNDS | EXELIXIS INC (US) | 2010-03-03 | — | — | EP | disclosed |
| 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 |