Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 8/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12197282 | 0.91 | CYP17A1 (0.49) | CYP17A1CYP19A1EPHX2ALDH1A1 | |
| SCHEMBL6744513 | 0.83 | CYP17A1 (0.43) | CYP17A1CYP19A1EPHX2 | |
| SCHEMBL119734 | 0.82 | CYP19A1 (0.50) | CYP17A1CYP19A1ALDH1A1 | |
| SCHEMBL15041028 | 0.81 | CYP17A1 (0.42) | CYP17A1CYP19A1EPHX2TP53 | |
| SCHEMBL13527839 | 0.81 | CYP17A1 (0.47) | CYP17A1CYP19A1 | |
| SCHEMBL16121051 | 0.80 | CES2 (0.42) | CYP17A1CYP19A1EPHX2TP53 | |
| SCHEMBL14871543 | 0.79 | CES2 (0.45) | CYP17A1CYP19A1EPHX2TP53 | |
| SCHEMBL11948969 | 0.79 | CYP17A1 (0.39) | CYP17A1CYP19A1EPHX2 | |
| SCHEMBL17322536 | 0.79 | CYP19A1 (0.50) | CYP17A1CYP19A1 | |
| SCHEMBL13588098 | 0.79 | CYP17A1 (0.45) | CYP17A1CYP19A1ALDH1A1 |
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-6280897-B1 | GENERATION OF ACID WITH ACTINIC RADIATION | KABUSHIKI KAISHA TOSHIBA (JP) | 2001-08-28 | — | — | US | disclosed |