Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 7/20 | 0.39 |
| ▸ | DHODH | Q02127 | 11/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6308458 | 0.99 | PGR (0.40) | PGRDHODHARBRD4CTSK | |
| SCHEMBL7157679 | 0.98 | PGR (0.39) | PGRDHODHARBRD4CTSK | |
| SCHEMBL6307788 | 0.89 | CTSK (0.36) | PGRDHODHARBRD4CTSK | |
| SCHEMBL6106477 | 0.89 | DHODH (0.40) | PGRDHODHCTSK | |
| SCHEMBL8829582 | 0.84 | DHODH (0.42) | DHODHCTSK | |
| SCHEMBL6310409 | 0.84 | PGR (0.39) | PGRDHODHARBRD4 | |
| SCHEMBL6174842 | 0.82 | PGR (0.41) | PGRARBRD4 | |
| SCHEMBL6310318 | 0.81 | CTSK (0.36) | DHODHARCTSK | |
| SCHEMBL6103445 | 0.80 | DHODH (0.42) | DHODHCTSK | |
| SCHEMBL7754754 | 0.80 | AR (0.38) | PGRARBRD4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6541667-B1 | Mixing a nitrile with an aqueous solution comprising a sulfide and water | BAYER CORPORATION | 2003-04-01 | — | — | US | claimed |
| US-6541667-B1 | Mixing a nitrile with an aqueous solution comprising a sulfide and water | BAYER CORPORATION | 2003-04-01 | — | — | US | disclosed |