Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 2/20 | 0.37 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL11311694 | 0.80 | MEP1A (0.34) | TAAR1CYP3A4MAPK1 | |
| SCHEMBL6305999 | 0.80 | CYP3A4 (0.40) | TAAR1CYP3A4MAPK1AHRPNMT | |
| SCHEMBL3124138 | 0.79 | TAAR1 (0.63) | TAAR1CYP3A4PNMT | |
| SCHEMBL30252677 | 0.79 | TAAR1 (0.63) | TAAR1CYP3A4PNMT | |
| SCHEMBL10920592 | 0.79 | TAAR1 (0.31) | TAAR1 | |
| SCHEMBL9482589 | 0.78 | TAAR1 (0.40) | TAAR1CYP3A4MAPK1AHRPNMT | |
| SCHEMBL8893652 | 0.76 | TAAR1 (0.65) | TAAR1CYP3A4MAPK1PNMT | |
| SCHEMBL10061111 | 0.76 | TAAR1 (0.39) | TAAR1CYP3A4MAPK1AHRPNMT | |
| SCHEMBL17552721 | 0.76 | TAAR1 (0.39) | TAAR1CYP3A4MAPK1AHRPNMT | |
| SCHEMBL5477243 | 0.76 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0604857-B1 | Process for preparing optically active 4-mercapto-2-pyrrolidone derivative and intermediate therefor | TANABE SEIYAKU CO (JP) | 1999-03-17 | — | — | EP | disclosed |
| US-5495012-A | Process for preparing optically active 4-mercapto-2-pyrrolidone derivative and intermediate therefor | TANABE SEIYAKU CO., LTD. (JP) | 1996-02-27 | — | — | US | disclosed |
| US-5424446-A | Process for preparing optically active 4-mercapto-2-pyrrolidone derivative and intermediate therefor | TANABE SEIYAKU CO., LTD. (JP) | 1995-06-13 | — | — | US | disclosed |
| EP-0604857-A1 | Process for preparing optically active 4-mercapto-2-pyrrolidone derivative and intermediate therefor | TANABE SEIYAKU CO., LTD. (JP) | 1994-07-06 | — | — | EP | disclosed |