Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30886706 | 0.82 | CYP1A2 (0.51) | CYP1A2CA1CA9 | |
| SCHEMBL10100066 | 0.82 | CYP1A2 (0.51) | CYP1A2CA1CA9 | |
| SCHEMBL19275487 | 0.79 | CYP1A2 (0.53) | CYP1A2CA1CA9PPARG | |
| SCHEMBL10299643 | 0.79 | — | — | |
| SCHEMBL28238525 | 0.78 | CYP1A2 (0.33) | CYP1A2 | |
| SCHEMBL1771763 | 0.78 | CYP1A2 (0.56) | CYP1A2CA1CA9PPARG | |
| SCHEMBL30754353 | 0.78 | CYP1A2 (0.56) | CYP1A2CA1CA9PPARG | |
| SCHEMBL9217047 | 0.78 | CYP1A2 (0.56) | CYP1A2CA1CA9PPARG | |
| SCHEMBL1771764 | 0.78 | CYP1A2 (0.56) | CYP1A2CA1CA9PPARG | |
| SCHEMBL30689544 | 0.78 | CYP1A2 (0.56) | CYP1A2CA1CA9PPARG |
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 |
|---|---|---|---|---|---|---|---|
| JP-3151372-A | — | — | None | — | — | JP | disclosed |
| JP-H03151372-A | PRODUCTION OF GAMMA-JASMOLACTONE | TOYOTAMA KORYO KK | 1991-06-27 | — | — | JP | disclosed |