Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 4/20 | 0.32 |
| ▸ | JAK3 | P52333 | 4/20 | 0.32 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.31 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | SCN10A | Q9Y5Y9 | 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 | |
|---|---|---|---|---|
| SCHEMBL14928541 | 0.86 | KHK (0.47) | KHKKDM4EGAAJAK2JAK3 | |
| SCHEMBL14910034 | 0.83 | KHK (0.44) | KHKKDM4EGAAJAK2JAK3 | |
| SCHEMBL16165070 | 0.81 | KHK (0.42) | KHKKDM4EGAAJAK2JAK3 | |
| SCHEMBL15081501 | 0.81 | KHK (0.42) | KHKKDM4EGAAJAK2JAK3 | |
| SCHEMBL16165493 | 0.81 | KHK (0.42) | KHKKDM4EGAAJAK2JAK3 | |
| SCHEMBL3389612 | 0.80 | KHK (0.51) | KHKKDM4EGAAJAK2JAK3 | |
| SCHEMBL14923561 | 0.80 | KHK (0.51) | KHKKDM4EGAAJAK2JAK3 | |
| SCHEMBL14909031 | 0.80 | KHK (0.51) | KHKKDM4EGAAJAK2JAK3 | |
| SCHEMBL14911089 | 0.80 | KHK (0.48) | KHKKDM4EGAAJAK2JAK3 | |
| SCHEMBL14911090 | 0.80 | KHK (0.48) | KHKKDM4EGAAJAK2JAK3 |
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 |