Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | ACACA | Q13085 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL27035286 | 0.96 | NPC1 (0.45) | NPC1ALDH1A1MAPTRAB9AL3MBTL1 | |
| SCHEMBL27035144 | 0.93 | PTGES (0.44) | NPC1ALDH1A1MAPTRAB9AHTT | |
| SCHEMBL27034944 | 0.85 | HTR1A (0.48) | NPC1ALDH1A1MAPTRAB9AHTT | |
| SCHEMBL27035204 | 0.78 | SMN1; SMN2 (0.56) | NPC1ALDH1A1MAPTRAB9AL3MBTL1 | |
| SCHEMBL27035097 | 0.77 | TSHR (0.57) | NPC1ALDH1A1MAPTRAB9AL3MBTL1 | |
| SCHEMBL27035133 | 0.77 | MAPT (0.65) | NPC1ALDH1A1MAPTRAB9AHTT | |
| SCHEMBL27034997 | 0.77 | NPC1 (0.67) | NPC1ALDH1A1MAPTRAB9AL3MBTL1 | |
| SCHEMBL27034989 | 0.75 | ALDH1A1 (0.68) | NPC1ALDH1A1MAPTRAB9AL3MBTL1 | |
| SCHEMBL8428106 | 0.74 | MAPT (0.54) | NPC1ALDH1A1MAPTRAB9AL3MBTL1 | |
| SCHEMBL27034912 | 0.73 | TSHR (0.60) | NPC1ALDH1A1MAPTRAB9AL3MBTL1 |
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-2024019685-A2 | NOVEL 3,5-DISUBSTITUTED-1,2,4-OXADIAZOLE DERIVED COMPOUNDS AND INHIBITORY ACTIVITY OF THESE COMPOUNDS ON CARBONIC ANHYDRASE I AND II ENZYMES | ANADOLU UNIVERSITESI (TR) | 2024-01-25 | — | — | WO | claimed |