Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 2/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL21312412 | 0.83 | CA1 (0.48) | CA1CA2ALDH1A1CYP3A4ATM | |
| SCHEMBL7223140 | 0.82 | CA1 (0.44) | CA1CA2ALDH1A1CYP3A4ATM | |
| SCHEMBL2528932 | 0.82 | ACHE (0.47) | CA1CA2ALDH1A1CYP3A4ATM | |
| SCHEMBL1695876 | 0.81 | CA2 (0.56) | CA1CA2CYP3A4ATMTSHR | |
| SCHEMBL7218218 | 0.81 | CA1 (0.47) | CA1CA2ALDH1A1CYP3A4ATM | |
| SCHEMBL5458029 | 0.81 | ALDH1A1 (0.52) | CA1CA2ALDH1A1CYP3A4ATM | |
| SCHEMBL18859460 | 0.81 | ALDH1A1 (0.52) | CA1CA2ALDH1A1CYP3A4ATM | |
| SCHEMBL2529452 | 0.80 | CA1 (0.42) | CA1CA2ALDH1A1ATMTSHR | |
| SCHEMBL7222715 | 0.80 | CA1 (0.50) | CA1CA2ALDH1A1CYP3A4ATM | |
| SCHEMBL3674422 | 0.80 | ALDH1A1 (0.35) | ALDH1A1CYP3A4TDP1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1199300-B1 | Production of esters for use as lubricating base stock | NOF CORP (JP) | 2007-08-22 | — | — | EP | disclosed |
| US-5202044-A | Mixture of fluorohydrocarbon, epoxycyclo(pentane or hexane), and ester | KAO CORPORATION (JP) | 1993-04-13 | — | — | US | disclosed |