Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 6/20 | 0.33 |
| ▸ | CDC7 | O00311 | 2/20 | 0.33 |
| ▸ | IGF1R | P08069 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
| ▸ | PAK4 | O96013 | 2/20 | 0.32 |
| ▸ | WEE1 | P30291 | 1/20 | 0.32 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.31 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24094298 | 0.84 | KDR (0.38) | PIK3CAKDRCDC7ROCK2SYK | |
| SCHEMBL21217527 | 0.83 | MKNK1 (0.40) | KDRCDC7MKNK1ROCK2MAPKAPK2 | |
| SCHEMBL21217774 | 0.83 | CACNA2D1 (0.37) | KDRCDC7IGF1RMKNK1PAK4 | |
| SCHEMBL21217817 | 0.83 | ROCK2 (0.37) | PIK3CAKDRCDC7IGF1RPAK4 | |
| SCHEMBL21217824 | 0.82 | ROCK2 (0.44) | KDRMKNK1ROCK2MAPKAPK2 | |
| SCHEMBL24094335 | 0.82 | ROCK2 (0.38) | KDRMKNK1ROCK2MAPKAPK2 | |
| SCHEMBL24094099 | 0.81 | ROCK2 (0.42) | KDRROCK2 | |
| SCHEMBL21217528 | 0.80 | ROCK1 (0.37) | ROCK2SYK | |
| SCHEMBL21217818 | 0.79 | MKNK1 (0.40) | MKNK1ROCK2 | |
| SCHEMBL21217621 | 0.78 | TNIK (0.41) | KDRIGF1RROCK2SYK |
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-3743420-B1 | HETEROCYCLYLAMINO-SUBSTITUTED TRIAZOLES AS MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE | REDX PHARMA PLC (GB) | 2021-12-15 | — | — | EP | disclosed |