Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 3/20 | 0.62 |
| ▸ | RPS6KB1 | P23443 | 13/20 | 0.50 |
| ▸ | AKT1 | P31749 | 2/20 | 0.50 |
| ▸ | JAK2 | O60674 | 1/20 | 0.50 |
| ▸ | JAK1 | P23458 | 1/20 | 0.50 |
| ▸ | JAK3 | P52333 | 1/20 | 0.50 |
| ▸ | AURKA | O14965 | 11/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.46 |
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL3712006 | 0.89 | RPS6KB1 (0.63) | KDRRPS6KB1AKT1JAK2JAK1 | |
| SCHEMBL1466583 | 0.83 | KDR (0.60) | KDRCLK4HDAC3HDAC1HDAC2 | |
| SCHEMBL5261234 | 0.81 | KDR (0.62) | KDRRPS6KB1CDC7ROCK2MAP4K4 | |
| SCHEMBL30595572 | 0.81 | KDR (0.62) | KDRRPS6KB1CDC7ROCK2MAP4K4 | |
| SCHEMBL22261196 | 0.80 | JAK3 (0.55) | KDRJAK2JAK1JAK3CDC7 | |
| SCHEMBL7126529 | 0.77 | JAK3 (0.58) | JAK2JAK1JAK3 | |
| SCHEMBL5718472 | 0.76 | KDM4C (0.66) | CDC7ROCK2MAP4K4GSK3BCLK4 | |
| SCHEMBL29622796 | 0.76 | RPS6KB1 (0.64) | RPS6KB1AKT1JAK2JAK1JAK3 | |
| SCHEMBL429092 | 0.75 | KDR (0.78) | KDR | |
| SCHEMBL29622729 | 0.75 | CYP1A2 (0.58) | RPS6KB1AKT1JAK3AURKAAURKB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1358184-A1 | SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE | Amgen Inc. (US) | 2003-11-05 | — | — | EP | disclosed |
| WO-2002066470-A1 | SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE | AMGEN INC. (US) | 2002-08-29 | — | — | WO | disclosed |