Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.54 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | WNT3A | P56704 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.50 |
| ▸ | GSK3A | P49840 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.50 |
| ▸ | APP | P05067 | 1/20 | 0.50 |
| ▸ | PRKACA | P17612 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13376861 | 0.88 | ROCK1 (0.65) | MAPTALDH1A1ROCK1CYP3A4PRKACA | |
| SCHEMBL13865104 | 0.87 | ALPL (0.54) | MAPTALDH1A1ROCK1MEN1KMT2A | |
| SCHEMBL13865106 | 0.86 | NPC1 (0.59) | MAPTALDH1A1ROCK1KMT2ASMN1; SMN2 | |
| SCHEMBL13376907 | 0.85 | GLS (0.48) | MAPTALDH1A1ROCK1MEN1KMT2A | |
| SCHEMBL13376935 | 0.85 | ROCK1 (0.59) | ROCK1MEN1KMT2AWNT3AGSK3B | |
| SCHEMBL13376879 | 0.84 | ROCK1 (0.57) | MAPTALDH1A1ROCK1WNT3APRKACA | |
| SCHEMBL13865111 | 0.82 | NPY5R (0.53) | ROCK1MEN1KMT2AMAPK8WNT3A | |
| SCHEMBL6386962 | 0.81 | CDK2 (0.51) | MAPTALDH1A1ROCK1MEN1KMT2A | |
| SCHEMBL6386968 | 0.81 | CDK2 (0.51) | MAPTALDH1A1ROCK1MEN1KMT2A | |
| SCHEMBL7922566 | 0.81 | MAPT (0.59) | MAPTALDH1A1MEN1KMT2ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7531556-B2 | Compositions useful as inhibitors of rock and other protein kinases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-05-12 | — | — | US | disclosed |
| US-7531556-B2 | Compositions useful as inhibitors of rock and other protein kinases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-05-12 | — | — | US | disclosed |