Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.40 |
| ▸ | KDM5A | P29375 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.37 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.37 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.37 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.37 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.37 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.34 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.34 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.34 |
| ▸ | CCKAR | P32238 | 3/20 | 0.33 |
| ▸ | CCKBR | P32239 | 3/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6669268 | 0.93 | ROCK2 (0.38) | ROCK2KDM5AKDM5BPSEN1PSEN2 | |
| SCHEMBL6664689 | 0.92 | PSEN1 (0.43) | ROCK2KDM5AKDM5BPSEN1PSEN2 | |
| SCHEMBL6663962 | 0.90 | ROCK2 (0.46) | ROCK2PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL6681227 | 0.90 | PRKAG1 (0.39) | ROCK2KDM5AKDM5BPRKAG1PRKAA2 | |
| SCHEMBL6665597 | 0.88 | ROCK2 (0.41) | ROCK2KDM5AKDM5BROCK1NR1H2 | |
| SCHEMBL6662371 | 0.86 | MAOB (0.38) | ROCK2KDM5AKDM5BPSEN1PSEN2 | |
| SCHEMBL6667909 | 0.86 | NNMT (0.40) | KDM5AKDM5BPSEN1PSEN2APH1B | |
| SCHEMBL6685279 | 0.83 | NR1H2 (0.38) | ROCK2KDM5AKDM5BCCKARCCKBR | |
| Niacinamide SCHEMBL6669309 | 0.82 | PSEN1 (0.41) | ROCK2PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL6680077 | 0.81 | NR1H2 (0.40) | KDM5AKDM5BPSEN1PSEN2APH1B |
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-2004014388-A1 | 6,6-FUSED HETEROARYL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |