Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 2/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.52 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.52 |
| ▸ | GSK3B | P49841 | 2/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.52 |
| ▸ | PIM1 | P11309 | 1/20 | 0.52 |
| ▸ | CDK2 | P24941 | 1/20 | 0.52 |
| ▸ | RPS6KB1 | P23443 | 6/20 | 0.49 |
| ▸ | AURKA | O14965 | 3/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.45 |
| ▸ | KDM6B | O15054 | 1/20 | 0.45 |
| ▸ | KDM4A | O75164 | 1/20 | 0.45 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7012861 | 0.87 | RPS6KB1 (0.55) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL27847518 | 0.81 | KDM4C (0.67) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL3714861 | 0.80 | MAPT (0.64) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL12322701 | 0.78 | JAK3 (0.54) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL12321553 | 0.77 | JAK3 (0.53) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL2480070 | 0.77 | RPS6KB1 (0.48) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL2122995 | 0.76 | MKNK1 (0.57) | CDC7KDM4EALDH1A1GAAMAPT | |
| SCHEMBL15639467 | 0.75 | SIRT3 (0.46) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL2728973 | 0.75 | AURKA (0.64) | ROCK2RPS6KB1AURKAAURKBKDM4E | |
| SCHEMBL11546498 | 0.74 | RPS6KB1 (0.43) | CDC7ROCK2MAP4K4GSK3BCLK4 |
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-2023100918-A1 | NOVEL NICOTINAMIDE COMPOUND AND USE THEREFOR | 興和株式会社 | 2023-06-08 | — | — | WO | disclosed |