Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.56 |
| ▸ | ATR | Q13535 | 10/20 | 0.49 |
| ▸ | PRKDC | P78527 | 5/20 | 0.49 |
| ▸ | ATM | Q13315 | 4/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.48 |
| ▸ | MINK1 | Q8N4C8 | 2/20 | 0.48 |
| ▸ | FYN | P06241 | 2/20 | 0.48 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.48 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.46 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL23093419 | 1.00 | KCNH2 (0.56) | KCNH2ATRPRKDCATMMAP4K4 | |
| SCHEMBL23093414 | 0.83 | KCNH2 (0.55) | KCNH2ATRPRKDCATMMAP4K4 | |
| SCHEMBL23093139 | 0.81 | LRRK2 (0.48) | KCNH2ATRFYN | |
| SCHEMBL16425220 | 0.80 | KCNH2 (0.69) | KCNH2ATRPRKDCATM | |
| SCHEMBL23093191 | 0.79 | PTGS2 (0.42) | — | |
| SCHEMBL29802518 | 0.79 | PTGS2 (0.42) | — | |
| SCHEMBL20371190 | 0.78 | ABL1 (0.46) | ATRMAP4K4 | |
| SCHEMBL12488659 | 0.78 | ALDH1A1 (0.41) | ATRATM | |
| SCHEMBL23093381 | 0.77 | PTGS2 (0.43) | KCNH2 | |
| SCHEMBL29802439 | 0.77 | PTGS2 (0.43) | KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4027993-A1 | CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF | The Broad Institute Inc. (US) | 2022-07-20 | — | — | EP | disclosed |