Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 15/20 | 0.66 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.66 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.64 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.53 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.52 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.52 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL19860039 | 0.87 | ROCK2 (0.65) | ROCK2ROCK1IMPDH2NOTUM | |
| SCHEMBL19860038 | 0.87 | PRMT3 (0.60) | ROCK2ROCK1IMPDH2NOTUM | |
| SCHEMBL19860041 | 0.87 | ROCK2 (0.59) | ROCK2ROCK1IMPDH2NOTUMSLC1A3 | |
| SCHEMBL20353584 | 0.84 | ROCK2 (0.62) | ROCK2ROCK1 | |
| SCHEMBL20353450 | 0.84 | ROCK2 (0.69) | ROCK2ROCK1IMPDH2 | |
| SCHEMBL12042256 | 0.83 | ROCK2 (0.55) | ROCK2ROCK1IMPDH2NOTUM | |
| SCHEMBL19860037 | 0.81 | NOTUM (0.55) | ROCK2ROCK1IMPDH2NOTUM | |
| SCHEMBL20353447 | 0.81 | ROCK2 (0.60) | ROCK2ROCK1 | |
| SCHEMBL11975549 | 0.81 | ROCK2 (0.57) | ROCK2ROCK1IMPDH2NOTUM | |
| SCHEMBL13764336 | 0.80 | ROCK2 (1.00) | ROCK2ROCK1IMPDH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9890123-B2 | 6-aminoisoquinoline compounds | AERIE PHARMACEUTICALS, INC. (US) | 2018-02-13 | — | — | US | disclosed |