Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL11532640 | 0.88 | NPC1 (0.58) | NPC1CYP1A2HRH3LTA4H | |
| SCHEMBL18912343 | 0.83 | NPC1 (0.56) | NPC1CYP1A2HRH3LTA4H | |
| SCHEMBL22666645 | 0.80 | NPC1 (0.49) | NPC1HRH3LTA4H | |
| SCHEMBL13367 | 0.79 | NPC1 (0.66) | NPC1CYP1A2HRH3LTA4H | |
| SCHEMBL17285625 | 0.77 | L3MBTL1 (0.44) | NPC1CYP1A2CYP3A4CYP2D6KDM4E | |
| SCHEMBL17033973 | 0.77 | LIPC (0.38) | NPC1HRH3CYP2D6 | |
| SCHEMBL15833659 | 0.77 | LIPG (0.35) | NPC1CYP1A2HRH3CYP3A4CYP2D6 | |
| SCHEMBL26280663 | 0.77 | LIPC (0.38) | NPC1HRH3CYP2D6 | |
| SCHEMBL26280657 | 0.77 | LIPC (0.38) | NPC1HRH3CYP2D6 | |
| SCHEMBL13818493 | 0.76 | HRH3 (0.38) | CYP1A2HRH3CYP3A4CYP2D6KDM4E |
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-2022090711-A1 | COMPOUNDS AS CD73 INHIBITORS | AdoRx Therapeutics Limited (GB) | 2022-05-05 | — | — | WO | disclosed |