Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 8/20 | 0.38 |
| ▸ | STAT6 | P42226 | 2/20 | 0.38 |
| ▸ | HRH1 | P35367 | 2/20 | 0.37 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | HRH2 | P25021 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.35 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | CHUK | O15111 | 1/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.34 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.34 |
| ▸ | PRKCG | P05129 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | MARK3 | P27448 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9302110 | 0.83 | ACHE (0.35) | ACHEHRH4STAT6HRH1PDE5A | |
| SCHEMBL9301180 | 0.67 | HTR6 (0.36) | ACHEHRH4HRH1PDE5AHRH2 | |
| SCHEMBL9302522 | 0.66 | SIRT6 (0.47) | ACHEHRH4PDE5AHTR6MET | |
| SCHEMBL9302311 | 0.64 | CYP11B2 (0.44) | IRAK4 | |
| Hydrochloric Acid SCHEMBL9302957 | 0.63 | CYP11B1 (0.43) | — | |
| SCHEMBL9302144 | 0.62 | GRM5 (0.39) | HRH4 | |
| SCHEMBL5170379 | 0.57 | GAA (0.47) | HRH4 | |
| SCHEMBL16489514 | 0.56 | HRH4 (0.62) | ACHEHRH4HRH1PDE5AHRH2 | |
| SCHEMBL5790195 | 0.56 | AGXT (0.61) | HRH1HRH2HRH3HTR6AURKA | |
| SCHEMBL1588414 | 0.56 | HRH4 (0.81) | ACHEHRH4HRH1HRH2HRH3 |
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-5283248-A | Bactericides, enzyme inhibitor of DNA-gyrase in bacteria | HOFFMANN-LA ROCHE INC. (US) | 1994-02-01 | — | — | US | disclosed |