Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | SMO | Q99835 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23487744 | 0.90 | ALOX5AP (0.44) | ALOX5APFEN1PLAUCYP2A6ADORA1 | |
| SCHEMBL25100959 | 0.88 | CYP2A6 (0.47) | ALOX5APFEN1CYP2A6ADORA1MAP4K4 | |
| SCHEMBL21289783 | 0.83 | CYP2A6 (0.52) | ALOX5APFEN1CYP2A6ADORA1MAP4K4 | |
| SCHEMBL21290182 | 0.83 | CYP2A6 (0.52) | ALOX5APFEN1CYP2A6ADORA1MAP4K4 | |
| SCHEMBL23487747 | 0.82 | L3MBTL1 (0.45) | ALOX5APFEN1CYP2A6ADORA1MAP4K4 | |
| SCHEMBL23487496 | 0.76 | AHR (0.42) | ALOX5APFEN1CYP2A6ADORA1MAP4K4 | |
| SCHEMBL21289780 | 0.75 | LDHA (0.43) | ALOX5APFEN1CYP2A6ADORA1MAP4K4 | |
| SCHEMBL21290222 | 0.75 | ROS1 (0.43) | ALOX5APFEN1ADORA1MAP4K4ADORA2A | |
| SCHEMBL21290223 | 0.74 | L3MBTL1 (0.41) | ALOX5APFEN1CYP2A6ADORA1MAP4K4 | |
| SCHEMBL24292265 | 0.74 | L3MBTL1 (0.41) | ALOX5APFEN1CYP2A6ADORA1MAP4K4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019158453-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2019-08-22 | — | — | WO | disclosed |