Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 9/20 | 0.41 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.41 |
| ▸ | SMO | Q99835 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.37 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
| ▸ | MKNK1 | Q9BUB5 | 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 | |
|---|---|---|---|---|
| SCHEMBL24610341 | 0.88 | TNIK (0.45) | TNIKROCK2CACNA2D1SMOMEN1 | |
| SCHEMBL21217815 | 0.86 | ROCK2 (0.53) | TNIKROCK2CACNA2D1SMOMEN1 | |
| SCHEMBL21217532 | 0.86 | TNIK (0.44) | TNIKROCK2CACNA2D1SMOMEN1 | |
| SCHEMBL21198538 | 0.85 | ROCK2 (0.56) | TNIKROCK2CACNA2D1SMOMEN1 | |
| SCHEMBL24094324 | 0.85 | TNIK (0.43) | TNIKROCK2CACNA2D1SMOMEN1 | |
| SCHEMBL22966729 | 0.85 | TNIK (0.44) | TNIKROCK2CACNA2D1SMOMEN1 | |
| SCHEMBL24610279 | 0.84 | MEN1 (0.50) | TNIKROCK2MEN1KMT2ANPC1 | |
| SCHEMBL21217751 | 0.84 | ROCK2 (0.46) | TNIKROCK2CACNA2D1MEN1KMT2A | |
| SCHEMBL21198160 | 0.84 | MEN1 (0.41) | TNIKROCK2CACNA2D1SMOMEN1 | |
| SCHEMBL29672455 | 0.84 | MEN1 (0.41) | TNIKROCK2CACNA2D1SMOMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4026834-A1 | HETEROCYCLYLAMINO-SUBSTITUTED TRIAZOLES AS MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE | Redx Pharma Plc (GB) | 2022-07-13 | — | — | EP | disclosed |
| WO-2019145729-A9 | HETEROCYCLYLAMINO-SUBSTITUTED TRIAZOLES AS MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE | REDX PHARMA PLC (GB) | 2020-07-30 | — | — | WO | disclosed |
| WO-2019145729-A1 | HETEROCYCLYLAMINO-SUBSTITUTED TRIAZOLES AS MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE | REDX PHARMA PLC (GB) | 2019-08-01 | — | — | WO | disclosed |