Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 3/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 5/20 | 0.39 |
| ▸ | RAB9A | P51151 | 5/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.39 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.38 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2013328 | 0.91 | L3MBTL1 (0.45) | L3MBTL1NPC1RAB9AALOX12METAP2 | |
| SCHEMBL2013778 | 0.89 | NPC1 (0.44) | MTNR1AMTNR1BL3MBTL1NPC1RAB9A | |
| SCHEMBL2017712 | 0.86 | NPC1 (0.43) | MTNR1AMTNR1BL3MBTL1NPC1RAB9A | |
| SCHEMBL2041986 | 0.86 | NPC1 (0.43) | MTNR1AMTNR1BL3MBTL1NPC1RAB9A | |
| SCHEMBL2035784 | 0.85 | NPC1 (0.43) | MTNR1AMTNR1BL3MBTL1NPC1RAB9A | |
| SCHEMBL2163699 | 0.85 | NPC1 (0.43) | MTNR1AMTNR1BL3MBTL1NPC1RAB9A | |
| SCHEMBL2012926 | 0.85 | SMO (0.48) | L3MBTL1NPC1RAB9AALOX12METAP2 | |
| SCHEMBL2018209 | 0.84 | BTK (0.36) | MTNR1AMTNR1BL3MBTL1NPC1RAB9A | |
| SCHEMBL2011476 | 0.82 | METAP2 (0.43) | L3MBTL1NPC1RAB9AALOX12METAP2 | |
| SCHEMBL2011479 | 0.82 | METAP2 (0.43) | L3MBTL1NPC1RAB9AALOX12METAP2 |
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 |