Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 5/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | IMPDH2 | P12268 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | PRMT3 | O60678 | 4/20 | 0.51 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.48 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.48 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2162616 | 0.85 | IMPDH2 (0.70) | NOTUMKDM4EIMPDH2ALDH1A1GAA | |
| SCHEMBL19860124 | 0.82 | IMPDH2 (0.59) | NOTUMKDM4EIMPDH2ALDH1A1PRMT3 | |
| SCHEMBL19860110 | 0.81 | IMPDH2 (0.59) | NOTUMIMPDH2PRMT3ROCK2ROCK1 | |
| SCHEMBL19860043 | 0.81 | NOTUM (0.63) | NOTUMKDM4EIMPDH2ALDH1A1PRMT3 | |
| SCHEMBL14456055 | 0.79 | LMNA (0.57) | NOTUMIMPDH2 | |
| SCHEMBL19860105 | 0.79 | PRMT3 (0.62) | NOTUMIMPDH2PRMT3 | |
| SCHEMBL19860108 | 0.79 | MEN1 (0.54) | NOTUMKDM4EIMPDH2ALDH1A1PRMT3 | |
| SCHEMBL3598434 | 0.78 | IMPDH2 (0.69) | NOTUMIMPDH2PRMT3ROCK2ROCK1 | |
| SCHEMBL19860125 | 0.78 | PRMT3 (0.71) | NOTUMIMPDH2PRMT3ROCK2ROCK1 | |
| SCHEMBL19860106 | 0.78 | ROCK1 (0.57) | NOTUMIMPDH2PRMT3ROCK2ROCK1 |
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 |