Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 4/20 | 0.39 |
| ▸ | AXL | P30530 | 2/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | METAP2 | P50579 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | DHPS | P49366 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25683544 | 0.80 | JAK2 (0.41) | JAK2JAK1IDO1ROCK1NOS1 | |
| SCHEMBL8404436 | 0.76 | IDO1 (0.46) | JAK2JAK1IDO1NOS1AXL | |
| SCHEMBL8306066 | 0.76 | JAK2 (0.68) | JAK2JAK1IDO1NOS1AXL | |
| SCHEMBL18411114 | 0.74 | IDO1 (0.41) | JAK2JAK1IDO1NOS1AXL | |
| SCHEMBL24933983 | 0.74 | ROCK1 (0.39) | JAK2JAK1IDO1ROCK1NOS1 | |
| SCHEMBL767506 | 0.73 | NOS1 (0.55) | JAK2JAK1IDO1NOS1AXL | |
| SCHEMBL23464679 | 0.73 | NOS1 (0.55) | JAK2JAK1IDO1NOS1AXL | |
| SCHEMBL7572936 | 0.73 | IDO1 (0.43) | JAK2JAK1IDO1ROCK1NOS1 | |
| SCHEMBL5404343 | 0.73 | FGFR1 (0.44) | JAK2JAK1IDO1NOS1AXL | |
| SCHEMBL7918824 | 0.73 | IDO1 (0.43) | JAK2JAK1IDO1NOS1AXL |
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 |