Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 3/20 | 0.30 |
| ▸ | JAK3 | P52333 | 3/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.30 |
| ▸ | LIMK2 | P53671 | 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 | |
|---|---|---|---|---|
| SCHEMBL3389276 | 0.92 | KHK (0.47) | KHKPKMPGK1POLBALDH1A1 | |
| SCHEMBL14928808 | 0.87 | KHK (0.42) | KHKPKMPGK1POLBALDH1A1 | |
| SCHEMBL14928686 | 0.87 | KHK (0.43) | KHKPKMPGK1POLBALDH1A1 | |
| SCHEMBL14928541 | 0.84 | KHK (0.47) | KHKPKMPGK1POLBALDH1A1 | |
| SCHEMBL14928834 | 0.83 | KHK (0.44) | KHKPKMPGK1POLBALDH1A1 | |
| SCHEMBL14928587 | 0.82 | KHK (0.42) | KHKPKMPGK1POLBALDH1A1 | |
| SCHEMBL14928731 | 0.82 | KHK (0.46) | KHKPKMPGK1POLBALDH1A1 | |
| SCHEMBL14928701 | 0.82 | KHK (0.46) | KHKPKMPGK1POLBALDH1A1 | |
| SCHEMBL3387733 | 0.81 | KHK (0.46) | KHKPKMPGK1POLBALDH1A1 | |
| SCHEMBL14909396 | 0.81 | KHK (0.46) | KHKPKMPGK1POLBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012002577-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | 富士フイルム株式会社 (JP) | 2012-01-05 | — | — | WO | disclosed |