Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 8/20 | 0.39 |
| ▸ | PDE2A | O00408 | 3/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 3/20 | 0.34 |
| ▸ | JAK1 | P23458 | 3/20 | 0.34 |
| ▸ | TYK2 | P29597 | 3/20 | 0.34 |
| ▸ | JAK3 | P52333 | 3/20 | 0.34 |
| ▸ | EPHB3 | P54753 | 1/20 | 0.33 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23888941 | 0.89 | NR1H4 (0.44) | ROCK2PDE2ANR1H4JAK2JAK1 | |
| SCHEMBL19127394 | 0.88 | LMNA (0.42) | ROCK2PDE2ANR1H4KDM4EALDH1A1 | |
| SCHEMBL19128902 | 0.88 | LMNA (0.42) | ROCK2PDE2ANR1H4KDM4EALDH1A1 | |
| SCHEMBL19127391 | 0.88 | LMNA (0.42) | ROCK2PDE2ANR1H4KDM4EALDH1A1 | |
| SCHEMBL17437950 | 0.85 | ROCK2 (0.47) | ROCK2PDE2AEPHB3 | |
| SCHEMBL31546959 | 0.82 | PLA2G4B (0.43) | PDE2AKDM4EALDH1A1 | |
| SCHEMBL17437934 | 0.81 | ROCK2 (0.39) | ROCK2PDE2A | |
| SCHEMBL25296904 | 0.79 | KDM4E (0.35) | ROCK2PDE2AKDM4EALDH1A1EPHB3 | |
| SCHEMBL17454506 | 0.79 | ROCK2 (0.48) | ROCK2PDE2AALDH1A1EPHB3 | |
| SCHEMBL15882108 | 0.79 | PRKAB2 (0.41) | ROCK2PDE2AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019014308-A1 | 5-MEMBERED AND BICYCLIC HETEROCYCLIC AMIDES AS INHIBITORS OF ROCK | BRISTOL-MYERS SQUIBB COMPANY (US) | 2019-01-17 | — | — | WO | disclosed |