Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 7/20 | 0.44 |
| ▸ | PPIA | P62937 | 1/20 | 0.41 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL13195028 | 0.94 | KCNH2 (0.47) | BRD4PPIAPTGESALOX5KCNH2 | |
| SCHEMBL15469718 | 0.93 | TLR8 (0.46) | BRD4PPIAPTGESALOX5KCNH2 | |
| SCHEMBL15469765 | 0.92 | KCNH2 (0.45) | BRD4PPIAKCNH2CYP11B1CYP11B2 | |
| SCHEMBL15469717 | 0.87 | BRD4 (0.42) | BRD4PPIAPTGESALOX5CYP11B1 | |
| SCHEMBL17123640 | 0.86 | TLR8 (0.42) | BRD4KCNH2TLR7TLR8 | |
| SCHEMBL20386619 | 0.83 | KCNH2 (0.48) | KCNH2TLR7TLR8CYP1A2CYP2D6 | |
| SCHEMBL17123643 | 0.83 | CYP1A2 (0.52) | BRD4PPIACYP11B1CYP11B2ADORA3 | |
| SCHEMBL20386594 | 0.81 | CYP1A2 (0.48) | BRD4PPIACYP11B1CYP11B2ADORA3 | |
| SCHEMBL15470054 | 0.79 | KCNH2 (0.59) | KCNH2TLR7TLR8CYP1A2CYP2D6 | |
| SCHEMBL19274231 | 0.79 | KCNH2 (0.53) | KCNH2TLR7TLR8CYP1A2CYP2D6 |
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-2903967-B3 | ACYLAMINOPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS AND FURTHER DISEASES | JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) | 2020-04-15 | — | — | EP | disclosed |