Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 3/20 | 0.61 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.60 |
| ▸ | NOTUM | Q6P988 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | IMPDH2 | P12268 | 3/20 | 0.53 |
| ▸ | PRMT3 | O60678 | 2/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL19860082 | 0.89 | ROCK1 (0.60) | ROCK1ROCK2NOTUMIMPDH2PRMT3 | |
| SCHEMBL24735962 | 0.87 | IMPDH2 (0.69) | ROCK1ROCK2NOTUMIMPDH2PRMT3 | |
| SCHEMBL19860106 | 0.85 | ROCK1 (0.57) | ROCK1ROCK2NOTUMIMPDH2PRMT3 | |
| SCHEMBL24736084 | 0.85 | ROCK1 (0.61) | ROCK1ROCK2NOTUMIMPDH2PRMT3 | |
| SCHEMBL24736559 | 0.85 | IMPDH2 (0.51) | ROCK1ROCK2NOTUMIMPDH2PRMT3 | |
| SCHEMBL19860093 | 0.85 | ROCK2 (0.61) | ROCK1ROCK2NOTUMSMN1; SMN2IMPDH2 | |
| SCHEMBL14625937 | 0.85 | ROCK2 (0.60) | ROCK1ROCK2NOTUMIMPDH2PRMT3 | |
| SCHEMBL24736108 | 0.83 | ROCK1 (0.49) | ROCK1ROCK2NOTUMIMPDH2PRMT3 | |
| SCHEMBL24736304 | 0.83 | ROCK1 (0.49) | ROCK1ROCK2NOTUMIMPDH2PRMT3 | |
| SCHEMBL23736265 | 0.82 | NOTUM (0.50) | ROCK1ROCK2NOTUMIMPDH2PRMT3 |
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 |