Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7100159 | 0.85 | HTT (0.43) | HTTGAAMAPTTRPV1NPC1 | |
| SCHEMBL28825411 | 0.83 | MAPT (0.44) | GAAMAPTTRPV1NPC1ALDH1A1 | |
| SCHEMBL22125737 | 0.82 | HTT (0.41) | HTTGAAMAPTTRPV1NPC1 | |
| SCHEMBL9052329 | 0.81 | MMP8 (0.50) | GAAMAPTTRPV1NPC1ALDH1A1 | |
| SCHEMBL16322386 | 0.80 | PSEN1 (0.49) | GAAMAPTTRPV1NPC1ALDH1A1 | |
| SCHEMBL6788771 | 0.79 | MAPT (0.43) | HTTGAAMAPTTRPV1NPC1 | |
| SCHEMBL1294957 | 0.78 | MAPT (0.43) | HTTGAAMAPTTRPV1MEN1 | |
| SCHEMBL1294963 | 0.78 | MAPT (0.43) | HTTGAAMAPTTRPV1MEN1 | |
| SCHEMBL31198068 | 0.77 | NPC1 (0.41) | GAAMAPTTRPV1NPC1ALDH1A1 | |
| SCHEMBL6368506 | 0.77 | MAPT (0.44) | GAAMAPTTRPV1NPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115768754-A | Dihydrooxazole and thiourea or urea derivatives that modulate NLRP3 inflammasome pathways | AC免疫有限公司 | 2023-03-07 | — | — | CN | disclosed |