Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA7 | P43166 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20944173 | 0.77 | ALDH1A1 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL30745018 | 0.76 | MAOA (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL14089785 | 0.73 | TSHR (0.72) | CA12CA1CA2CA7CA9 | |
| SCHEMBL19961545 | 0.72 | CYP1A2 (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2004474 | 0.72 | ESR1 (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2210778 | 0.72 | CYP1A2 (0.54) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5511149 | 0.71 | GRM1 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL28881719 | 0.71 | GABRG2 (0.45) | TSHRKDM4EALDH1A1HPGDESR2 | |
| SCHEMBL31208503 | 0.70 | MAPT (0.40) | TSHRALDH1A1NPC1LMNAMAPT | |
| SCHEMBL21865495 | 0.69 | CA12 (0.48) | CA12CA1CA2CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111295382-B | Bridged bicyclic compounds as farnesyl ester X receptor modulators | 百时美施贵宝公司 | 2024-02-02 | — | — | CN | disclosed |