Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTAFR | P25105 | 5/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 3/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8601471 | 0.90 | KCNA3 (0.32) | KCNA3 | |
| SCHEMBL8603644 | 0.87 | PTAFR (0.39) | PTAFRHDAC4HDAC1HDAC6AKR1C3 | |
| SCHEMBL8599406 | 0.86 | CYP19A1 (0.36) | PTAFRAKR1C3AKR1C2TBXAS1CYP2C9 | |
| SCHEMBL8604400 | 0.84 | KCNA3 (0.34) | KCNA3 | |
| SCHEMBL8603103 | 0.83 | PTAFR (0.43) | PTAFRMKNK1MKNK2AKR1C3AKR1C2 | |
| SCHEMBL8597829 | 0.80 | CYP11B1 (0.38) | MKNK1MKNK2AKR1C3AKR1C2TBXAS1 | |
| SCHEMBL8602104 | 0.79 | PTAFR (0.37) | PTAFRMKNK1MKNK2AKR1C3AKR1C2 | |
| SCHEMBL8601601 | 0.78 | ALDH1A1 (0.34) | ALOX15PTGS2 | |
| SCHEMBL8601603 | 0.78 | ALDH1A1 (0.34) | ALOX15PTGS2 | |
| SCHEMBL7554308 | 0.78 | ALDH1A1 (0.34) | ALOX15PTGS2 |
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-5779934-A | FLUORINATING AN ALCOHOL DERIVATIVE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-07-14 | — | — | US | disclosed |