Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 3/20 | 0.32 |
| ▸ | HTR2B | P41595 | 3/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23105382 | 0.75 | IDO1 (0.47) | IDO1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL25944648 | 0.75 | IDO1 (0.52) | IDO1SLC6A4SLC6A2SLC6A3DAO | |
| SCHEMBL30700735 | 0.73 | IDO1 (0.50) | IDO1SLC6A4SLC6A2SLC6A3DAO | |
| SCHEMBL16214946 | 0.71 | IDO1 (0.67) | IDO1SLC6A4SLC6A2SLC6A3DAO | |
| SCHEMBL21984758 | 0.69 | IDO1 (0.55) | IDO1SLC6A4SLC6A2SLC6A3DAO | |
| SCHEMBL3156002 | 0.69 | IDO1 (0.63) | IDO1SLC6A4SLC6A2SLC6A3DAO | |
| SCHEMBL23171806 | 0.68 | IDO1 (0.48) | IDO1SLC6A4SLC6A2SLC6A3DAO | |
| SCHEMBL23171801 | 0.68 | IDO1 (0.48) | IDO1SLC6A4SLC6A2SLC6A3DAO | |
| SCHEMBL23105381 | 0.68 | IDO1 (0.48) | IDO1SLC6A4SLC6A2SLC6A3DAO | |
| Trifluoroacetic Acid SCHEMBL31071611 | 0.68 | IDO1 (0.45) | IDO1SLC6A4SLC6A2SLC6A3DAO |
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-4028401-B1 | 4,4A,5,7,8,8A-HEXAPYRIDO[4,3-B][1,4]OXAZIN-3-ONE COMPOUNDS AS MAGL INHIBITORS | HOFFMANN LA ROCHE (CH) | 2023-11-22 | — | — | EP | disclosed |