Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.37 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2103328 | 0.88 | AKR1C3 (0.38) | AKR1C3AKR1C2NPBWR1KDM4EMAPT | |
| SCHEMBL2105515 | 0.87 | AKR1C3 (0.37) | AKR1C3AKR1C2NPBWR1KDM4EMAPT | |
| SCHEMBL2106428 | 0.80 | KIF11 (0.34) | — | |
| SCHEMBL17554823 | 0.78 | AKR1C3 (0.36) | AKR1C3AKR1C2NPBWR1MAPTAR | |
| SCHEMBL2105359 | 0.77 | AKR1C3 (0.36) | AKR1C3AKR1C2NPBWR1MAPTAR | |
| SCHEMBL17554936 | 0.77 | AKR1C3 (0.36) | AKR1C3AKR1C2NPBWR1MAPTAR | |
| SCHEMBL16462365 | 0.77 | AKR1C3 (0.35) | AKR1C3AKR1C2MAPTPTGS1ALDH1A1 | |
| SCHEMBL17554960 | 0.73 | AKR1C3 (0.35) | AKR1C3AKR1C2NPBWR1MAPTAR | |
| SCHEMBL1948387 | 0.72 | ALDH1A1 (0.38) | AKR1C3AKR1C2MAPTARPTGS1 | |
| SCHEMBL17554995 | 0.72 | AKR1C3 (0.34) | AKR1C3AKR1C2NPBWR1MAPTAR |
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-8163804-B2 | Composition for preventing harmful organisms | MITSUI CHEMICALS, INC. (JP) | 2012-04-24 | — | — | US | disclosed |