Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 3/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.37 |
| ▸ | ATXN2 | Q99700 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | PRKX | P51817 | 1/20 | 0.34 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL23149380 | 0.90 | SLC6A4 (0.44) | NAAAIDO1FFAR1ENPP2ATXN2 | |
| Trifluoroacetic Acid SCHEMBL23149384 | 0.90 | SLC6A4 (0.44) | NAAAIDO1FFAR1ENPP2ATXN2 | |
| Trifluoroacetic Acid SCHEMBL26649036 | 0.88 | NAAA (0.41) | NAAAIDO1FFAR1ENPP2ATXN2 | |
| SCHEMBL23105360 | 0.82 | SLC6A4 (0.50) | NAAAIDO1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL23105361 | 0.82 | SLC6A4 (0.50) | NAAAIDO1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL30700758 | 0.82 | SLC6A4 (0.50) | NAAAIDO1SLC6A4SLC6A2SLC6A3 | |
| Trifluoroacetic Acid SCHEMBL23091803 | 0.82 | NAAA (0.43) | NAAAIDO1FFAR1ENPP2ATXN2 | |
| Trifluoroacetic Acid SCHEMBL23152297 | 0.81 | IDO1 (0.47) | NAAAIDO1FFAR1ENPP2ATXN2 | |
| SCHEMBL23105362 | 0.79 | IDO1 (0.47) | NAAAIDO1SLC6A4SLC6A2SLC6A3 | |
| Trifluoroacetic Acid SCHEMBL30490311 | 0.79 | IDO1 (0.42) | NAAAIDO1FFAR1ENPP2ATXN2 |
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-114364682-A | Compound 4,4A,5,7,8, 8A-hexapyrido [4,3-B ] [1,4] oxazin-3-one as MAGL inhibitor | 豪夫迈·罗氏有限公司 | 2022-04-15 | — | — | CN | disclosed |