Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 3/20 | 0.52 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | PPARA | Q07869 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.42 |
| ▸ | ITGAV | P06756 | 1/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.42 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 2/20 | 0.41 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16856562 | 0.90 | CYP17A1 (0.53) | CYP17A1PPARGPPARADRD2PTGDR2 | |
| SCHEMBL20204187 | 0.90 | CYP17A1 (0.53) | CYP17A1PPARGPPARADRD2PTGDR2 | |
| SCHEMBL28747809 | 0.86 | PPARG (0.50) | CYP17A1PPARGPPARADRD2PTGDR2 | |
| SCHEMBL27577525 | 0.86 | PPARG (0.50) | CYP17A1PPARGPPARADRD2PTGDR2 | |
| SCHEMBL27916490 | 0.86 | CYP17A1 (0.54) | CYP17A1PPARGPPARADRD2PTGDR2 | |
| SCHEMBL7955771 | 0.84 | PPARA (0.50) | CYP17A1PPARGPPARADRD2PTGDR2 | |
| SCHEMBL20215005 | 0.84 | AURKA (0.47) | CYP17A1PPARGAURKARPS6KB1HDAC1 | |
| SCHEMBL7955775 | 0.84 | PPARA (0.50) | CYP17A1PPARGPPARADRD2PTGDR2 | |
| SCHEMBL21689917 | 0.83 | PPARG (0.55) | CYP17A1PPARGPPARADRD2PTGDR2 | |
| SCHEMBL2617177 | 0.83 | PPARG (0.55) | CYP17A1PPARGPPARADRD2PTGDR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2021335-A1 | HETEROCYCLIC COMPOUNDS AS INHIBITORS OF C-FMS KINASE | Janssen Pharmaceutica, N.V. (BE) | 2009-02-11 | — | — | EP | disclosed |
| WO-2007124316-A1 | HETEROCYCLIC COMPOUNDS AS INHIBITORS OF C-FMS KINASE | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-11-01 | — | — | WO | disclosed |