Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 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 | |
|---|---|---|---|---|
| SCHEMBL29358614 | 0.84 | BACE1 (0.45) | BACE1NOS3NOS1NOS2NPC1 | |
| SCHEMBL2259723 | 0.83 | LTA4H (0.53) | BACE1NOS3NOS1NOS2SMN1; SMN2 | |
| SCHEMBL9390459 | 0.82 | NOS3 (0.52) | BACE1NOS3NOS1NOS2NPC1 | |
| SCHEMBL9392352 | 0.82 | KEAP1 (0.52) | BACE1NOS3NOS1NOS2NPC1 | |
| SCHEMBL28428849 | 0.81 | MAPT (0.44) | BACE1NOS3NOS1NOS2LTA4H | |
| SCHEMBL3906522 | 0.79 | MPO (0.43) | NOS3NOS2MPOMAPTIDO1 | |
| SCHEMBL9391619 | 0.78 | NPC1 (0.61) | NOS3NOS1NOS2NPC1RAB9A | |
| SCHEMBL6636466 | 0.78 | SLC6A4 (0.52) | NPC1RAB9AMPO | |
| SCHEMBL10696454 | 0.76 | PARP1 (0.49) | NPC1RAB9ASMN1; SMN2PARP1MEN1 | |
| SCHEMBL28428643 | 0.76 | ALDH1A1 (0.55) | BACE1NOS3NOS1NOS2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4081199-A2 | LIPOXYGENASE INHIBITORS | SRI International (US) | 2022-11-02 | — | — | EP | disclosed |