Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.40 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | PDE2A | O00408 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19127391 | 0.91 | LMNA (0.42) | NR1H4ROCK2PDE2A | |
| SCHEMBL19128902 | 0.91 | LMNA (0.42) | NR1H4ROCK2PDE2A | |
| SCHEMBL19127394 | 0.91 | LMNA (0.42) | NR1H4ROCK2PDE2A | |
| SCHEMBL20653918 | 0.89 | ROCK2 (0.39) | NR1H4ROCK2JAK2JAK1TYK2 | |
| SCHEMBL17437950 | 0.88 | ROCK2 (0.47) | ROCK2PDE2A | |
| SCHEMBL31546959 | 0.85 | PLA2G4B (0.43) | PDE2AMAPT | |
| SCHEMBL17437934 | 0.84 | ROCK2 (0.39) | ROCK2PDE2A | |
| SCHEMBL25296904 | 0.82 | KDM4E (0.35) | ROCK2PDE2A | |
| SCHEMBL15882108 | 0.82 | PRKAB2 (0.41) | ROCK2PDE2AMAPT | |
| SCHEMBL17454506 | 0.82 | ROCK2 (0.48) | ROCK2PDE2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3402790-B1 | SPIROHEPTANE SALICYLAMIDES AND RELATED COMPOUNDS AS INHIBITORS OF ROCK | BRISTOL MYERS SQUIBB CO (US) | 2021-10-06 | — | — | EP | disclosed |