Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29263426 | 0.82 | — | — | |
| SCHEMBL14639360 | 0.77 | — | — | |
| SCHEMBL108022 | 0.75 | CA1 (0.48) | CA1BLMCYP1A2TRPA1 | |
| SCHEMBL14403217 | 0.73 | CA1 (0.46) | CA1BLMCYP1A2TRPA1 | |
| SCHEMBL28617281 | 0.73 | CA1 (0.46) | CA1BLMCYP1A2TRPA1 | |
| SCHEMBL13933249 | 0.71 | CA1 (0.44) | CA1BLMCYP1A2TRPA1 | |
| SCHEMBL800723 | 0.71 | CA1 (0.55) | CA1BLMCYP1A2TRPA1 | |
| SCHEMBL27962528 | 0.71 | CA1 (0.31) | CA1 | |
| SCHEMBL14359998 | 0.70 | — | — | |
| SCHEMBL8069171 | 0.70 | — | — |
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-4342582-A | — | — | None | — | — | JP | disclosed |
| JP-H04342582-A | PRODUCTION OF ELSHOLTZIA KETONE | TOYOTAMA KORYO KK | 1992-11-30 | — | — | JP | disclosed |