Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 4/20 | 0.60 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.54 |
| ▸ | PRMT3 | O60678 | 1/20 | 0.53 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.52 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.52 |
| ▸ | NOTUM | Q6P988 | 4/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL2164396 | 0.89 | IMPDH2 (0.58) | ROCK2TRPV1PRMT3IMPDH2MCHR1 | |
| SCHEMBL19860107 | 0.86 | ROCK2 (0.57) | ROCK2TRPV1PRMT3IMPDH2NOTUM | |
| SCHEMBL3566775 | 0.84 | PRMT3 (0.72) | ROCK2PRMT3IMPDH2NOTUM | |
| SCHEMBL2164137 | 0.82 | PRMT3 (0.69) | ROCK2PRMT3IMPDH2NOTUM | |
| SCHEMBL19860067 | 0.81 | PRMT3 (0.54) | ROCK2PRMT3IMPDH2NOTUM | |
| SCHEMBL19860079 | 0.80 | ALDH1A1 (0.61) | ROCK2PRMT3IMPDH2NOTUM | |
| SCHEMBL19860089 | 0.80 | ROCK2 (0.55) | ROCK2PRMT3IMPDH2NOTUM | |
| SCHEMBL19860064 | 0.80 | PRMT3 (0.54) | ROCK2PRMT3IMPDH2NOTUM | |
| SCHEMBL19860062 | 0.80 | ALDH1A1 (0.61) | ROCK2PRMT3IMPDH2NOTUM | |
| SCHEMBL19860082 | 0.79 | ROCK1 (0.60) | ROCK2PRMT3IMPDH2MCHR1NOTUM |
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 |