Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.37 |
| ▸ | BTK | Q06187 | 13/20 | 0.36 |
| ▸ | TEC | P42680 | 1/20 | 0.36 |
| ▸ | TXK | P42681 | 1/20 | 0.36 |
| ▸ | BMX | P51813 | 1/20 | 0.36 |
| ▸ | ITK | Q08881 | 1/20 | 0.36 |
| ▸ | HTR5A | P47898 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MPI | P34949 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2016578 | 0.93 | CNR2 (0.38) | NPC1RAB9AALOX12BTKL3MBTL1 | |
| SCHEMBL2018209 | 0.92 | BTK (0.36) | NPC1RAB9AALOX12BTKTEC | |
| SCHEMBL2014572 | 0.87 | AKT1 (0.38) | — | |
| SCHEMBL2014980 | 0.86 | SLC40A1 (0.38) | NPC1RAB9AALOX12HTR5AL3MBTL1 | |
| SCHEMBL2014977 | 0.86 | SLC40A1 (0.38) | NPC1RAB9AALOX12HTR5AL3MBTL1 | |
| SCHEMBL2014683 | 0.85 | NPC1 (0.43) | NPC1RAB9AALOX12BTKTEC | |
| SCHEMBL2017050 | 0.85 | SLC40A1 (0.40) | NPC1RAB9AALOX12HTR5AL3MBTL1 | |
| SCHEMBL2013778 | 0.84 | NPC1 (0.44) | NPC1RAB9AALOX12HTR5AL3MBTL1 | |
| SCHEMBL2013837 | 0.83 | BTK (0.37) | NPC1RAB9ABTKL3MBTL1MEN1 | |
| Trifluoroacetic Acid SCHEMBL2013515 | 0.83 | SLC40A1 (0.36) | RAB9AL3MBTL1MAPTHTTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011075630-A1 | SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2011-06-23 | — | — | WO | claimed |
| WO-2011075630-A1 | SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2011-06-23 | — | — | WO | disclosed |