Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 6/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24610384 | 0.91 | ROCK2 (0.47) | NPC1MEN1KMT2AROCK1ROCK2 | |
| SCHEMBL24610388 | 0.89 | ROCK1 (0.50) | NPC1MEN1KMT2AROCK1ROCK2 | |
| SCHEMBL24094323 | 0.89 | ROCK2 (0.48) | NPC1MEN1KMT2AROCK1ROCK2 | |
| SCHEMBL21217816 | 0.88 | MEN1 (0.40) | NPC1MEN1KMT2AROCK1ROCK2 | |
| SCHEMBL24610411 | 0.87 | ROCK2 (0.49) | NPC1MEN1KMT2AROCK1ROCK2 | |
| SCHEMBL21217621 | 0.86 | TNIK (0.41) | NPC1ROCK1ROCK2RAB9AKDR | |
| SCHEMBL21217529 | 0.86 | ROCK2 (0.51) | ROCK1ROCK2 | |
| SCHEMBL24610385 | 0.86 | ROCK2 (0.49) | ROCK1ROCK2 | |
| SCHEMBL24094099 | 0.86 | ROCK2 (0.42) | NPC1MEN1KMT2AROCK1ROCK2 | |
| SCHEMBL21217527 | 0.85 | MKNK1 (0.40) | ROCK1ROCK2KDREGFR |
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 |