Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.49 |
| ▸ | CA1 | P00915 | 4/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL8752111 | 1.00 | CA2 (0.49) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL8752093 | 0.92 | CA2 (0.40) | CA2CA1MAPK1 | |
| SCHEMBL24603122 | 0.91 | HDAC1 (0.38) | CA2CA1NPSR1CYP3A4TSHR | |
| SCHEMBL8752147 | 0.90 | MAPT (0.38) | CA2CA1 | |
| SCHEMBL12793529 | 0.84 | CA1 (0.33) | CA2CA1ATMTSHR | |
| SCHEMBL13649271 | 0.81 | — | — | |
| SCHEMBL18267327 | 0.81 | — | — | |
| SCHEMBL18412469 | 0.79 | — | — | |
| SCHEMBL2759389 | 0.79 | — | — | |
| SCHEMBL8402511 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000273067-A | FLUORINE-CONTAINING ESTER COMPOUND | KAO CORP | 2000-10-03 | — | — | JP | disclosed |