Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.34 |
| ▸ | NCOA3 | Q9Y6Q9 | 2/20 | 0.34 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.34 |
| ▸ | ITGB2 | P05107 | 3/20 | 0.34 |
| ▸ | ICAM1 | P05362 | 3/20 | 0.34 |
| ▸ | ITGAL | P20701 | 3/20 | 0.34 |
| ▸ | AKT1 | P31749 | 2/20 | 0.34 |
| ▸ | BTK | Q06187 | 3/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CCNC | P24863 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | WHR1 | P49842 | 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 | |
|---|---|---|---|---|
| SCHEMBL2165765 | 0.96 | PIK3CD (0.42) | PIK3CDL3MBTL1NPC1RAB9AALOX12 | |
| Trifluoroacetic Acid SCHEMBL2054000 | 0.95 | PIK3CD (0.40) | PIK3CDL3MBTL1NPC1RAB9AALOX12 | |
| Trifluoroacetic Acid SCHEMBL2053921 | 0.93 | HRH4 (0.40) | PIK3CDL3MBTL1NPC1RAB9AALOX12 | |
| Trifluoroacetic Acid SCHEMBL2163852 | 0.92 | PIK3CD (0.42) | PIK3CDL3MBTL1NPC1RAB9AALOX12 | |
| SCHEMBL2016479 | 0.92 | PIK3CD (0.42) | PIK3CDL3MBTL1NPC1RAB9AALOX12 | |
| Trifluoroacetic Acid SCHEMBL2053228 | 0.91 | PIK3CD (0.39) | PIK3CDL3MBTL1NPC1RAB9AALOX12 | |
| Trifluoroacetic Acid SCHEMBL2163932 | 0.91 | PIK3CD (0.41) | PIK3CDL3MBTL1NPC1RAB9AALOX12 | |
| Trifluoroacetic Acid SCHEMBL2163679 | 0.91 | PIK3CD (0.42) | PIK3CDL3MBTL1NPC1RAB9AALOX12 | |
| Trifluoroacetic Acid SCHEMBL2054109 | 0.90 | PIK3CD (0.43) | PIK3CDL3MBTL1NPC1RAB9AALOX12 | |
| SCHEMBL2016572 | 0.90 | NPC1 (0.42) | PIK3CDL3MBTL1NPC1RAB9AALOX12 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011075630-A1 | SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2011-06-23 | — | — | WO | disclosed |