Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 5/20 | 0.65 |
| ▸ | PRMT3 | O60678 | 5/20 | 0.57 |
| ▸ | IMPDH2 | P12268 | 5/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4428374 | 0.87 | NOTUM (0.62) | NOTUMPRMT3IMPDH2ROCK2 | |
| SCHEMBL19860094 | 0.86 | NOTUM (0.68) | NOTUMPRMT3IMPDH2ROCK2 | |
| SCHEMBL19860096 | 0.84 | NOTUM (0.65) | NOTUMPRMT3IMPDH2SMN1; SMN2ALDH1A1 | |
| SCHEMBL2162926 | 0.84 | NOTUM (0.59) | NOTUMPRMT3IMPDH2ROCK2 | |
| SCHEMBL30176801 | 0.83 | KDM4E (0.66) | NOTUMPRMT3IMPDH2ALDH1A1ROCK2 | |
| SCHEMBL20262924 | 0.83 | KDM4E (0.66) | NOTUMPRMT3IMPDH2ALDH1A1ROCK2 | |
| SCHEMBL12201999 | 0.83 | NOTUM (0.67) | NOTUMPRMT3IMPDH2SMN1; SMN2ALDH1A1 | |
| SCHEMBL19860063 | 0.83 | NOTUM (0.64) | NOTUMPRMT3IMPDH2ALDH1A1ROCK2 | |
| SCHEMBL12201798 | 0.82 | PRMT3 (0.64) | NOTUMPRMT3IMPDH2ROCK2 | |
| SCHEMBL8576469 | 0.82 | MEN1 (0.68) | SMN1; SMN2PKMALDH1A1 |
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 |