Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 5/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | PRKCA | P17252 | 2/20 | 0.36 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.35 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1682656 | 0.88 | TSHR (0.37) | CA2CA1ALDH1A1FAAH | |
| SCHEMBL29029804 | 0.82 | CA2 (0.47) | CA2CA1MAPK1CTSKSLC1A3 | |
| SCHEMBL29263280 | 0.81 | CA2 (0.43) | CA2CA1MAPK1CTSKFAAH | |
| SCHEMBL23466829 | 0.79 | ALDH1A1 (0.35) | CA2CA1MAPK1ALDH1A1CTSK | |
| SCHEMBL7669873 | 0.79 | KCNH2 (0.41) | ALDH1A1 | |
| SCHEMBL3715866 | 0.76 | HCAR2 (0.42) | CA2FAAH | |
| SCHEMBL28731369 | 0.76 | CA2 (0.42) | CA2CA1FAAHSLC1A2SLC1A1 | |
| SCHEMBL28767432 | 0.76 | CA2 (0.42) | CA2CA1FAAHSLC1A2SLC1A1 | |
| SCHEMBL8407812 | 0.76 | FAAH (0.44) | FAAH | |
| SCHEMBL3715862 | 0.76 | HCAR2 (0.42) | CA2FAAH |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104593095-B | High-octane lead-free aviation gasoline | 国际壳牌研究有限公司 | 2019-06-18 | — | — | CN | claimed |
| CN-104593102-B | High-octane lead-free aviation gasoline | 国际壳牌研究有限公司 | 2019-06-18 | — | — | CN | claimed |
| CN-104593102-B | High-octane lead-free aviation gasoline | 国际壳牌研究有限公司 | 2019-06-18 | — | — | CN | disclosed |
| CN-104593095-B | High-octane lead-free aviation gasoline | 国际壳牌研究有限公司 | 2019-06-18 | — | — | CN | disclosed |
| EP-0810227-A1 | ISOXAZOLE DERIVATIVES | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1997-12-03 | — | — | EP | disclosed |