Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | RAF1 | P04049 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.37 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21581608 | 0.85 | NPC1 (0.42) | NPC1RAB9AMAPTSUV39H2AURKB | |
| SCHEMBL21581620 | 0.83 | LMNA (0.41) | NPC1RAB9AMAPTKMT2ASUV39H2 | |
| SCHEMBL21581599 | 0.83 | NPC1 (0.49) | NPC1RAB9AMAPTSUV39H2AURKB | |
| SCHEMBL21581551 | 0.81 | SCN9A (0.41) | NPC1RAB9AMAPTKMT2ASUV39H2 | |
| SCHEMBL31089695 | 0.81 | SCN9A (0.47) | MAPTSCN9A | |
| SCHEMBL21581631 | 0.81 | NPC1 (0.46) | NPC1RAB9AMAPTPKMKMT2A | |
| SCHEMBL21581622 | 0.80 | GRM5 (0.40) | NPC1RAB9AKMT2ASUV39H2AURKB | |
| SCHEMBL21581680 | 0.77 | SCN9A (0.36) | SCN9ABRD4LCK | |
| SCHEMBL22306005 | 0.74 | AURKB (0.46) | NPC1RAB9AKMT2ASUV39H2AURKB | |
| SCHEMBL30315832 | 0.74 | AURKB (0.46) | NPC1RAB9AKMT2ASUV39H2AURKB |
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-2019222816-A1 | SUBSTITUTED-PYRIDINYL COMPOUNDS AND USES THEREOF | BIONOMICS LIMITED (AU) | 2019-11-28 | — | — | WO | disclosed |