Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 1/20 | 0.51 |
| ▸ | JAK3 | P52333 | 5/20 | 0.35 |
| ▸ | JAK2 | O60674 | 4/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.35 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MUSK | O15146 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14923561 | 1.00 | KHK (0.51) | KHKJAK3JAK2LIMK1LIMK2 | |
| SCHEMBL14909031 | 1.00 | KHK (0.51) | KHKJAK3JAK2LIMK1LIMK2 | |
| SCHEMBL14928506 | 0.89 | KHK (0.50) | KHKJAK3JAK2LIMK1LIMK2 | |
| SCHEMBL14928564 | 0.89 | KHK (0.50) | KHKJAK3JAK2LIMK1LIMK2 | |
| SCHEMBL16169054 | 0.85 | KHK (0.48) | KHKJAK3JAK2LIMK1LIMK2 | |
| SCHEMBL14928541 | 0.84 | KHK (0.47) | KHKJAK3JAK2LIMK1LIMK2 | |
| SCHEMBL14928398 | 0.84 | KHK (0.46) | KHKJAK3JAK2LIMK1LIMK2 | |
| SCHEMBL16169029 | 0.83 | KHK (0.50) | KHKJAK3JAK2LIMK1LIMK2 | |
| SCHEMBL16169053 | 0.83 | KHK (0.44) | KHKJAK3JAK2LIMK1LIMK2 | |
| SCHEMBL14909860 | 0.82 | KHK (0.50) | KHKJAK3JAK2LIMK1LIMK2 |
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 |