Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAK4 | O96013 | 18/20 | 0.71 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | PRKCB | P05771 | 3/20 | 0.52 |
| ▸ | PLK4 | O00444 | 1/20 | 0.52 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.52 |
| ▸ | AURKA | O14965 | 1/20 | 0.52 |
| ▸ | GAK | O14976 | 1/20 | 0.52 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.52 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.52 |
| ▸ | STK16 | O75716 | 1/20 | 0.52 |
| ▸ | PAK3 | O75914 | 1/20 | 0.52 |
| ▸ | CDKL5 | O76039 | 1/20 | 0.52 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.52 |
| ▸ | LATS1 | O95835 | 1/20 | 0.52 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.52 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | PRKCG | P05129 | 1/20 | 0.52 |
| ▸ | FYN | P06241 | 1/20 | 0.52 |
| ▸ | YES1 | P07947 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL22164663 | 0.87 | PAK4 (0.66) | PAK4OPRM1PRKCBPLK4CHEK1 | |
| SCHEMBL29412167 | 0.84 | PAK4 (0.65) | PAK4OPRM1PRKCBPLK4CHEK1 | |
| SCHEMBL1942289 | 0.84 | PAK4 (1.00) | PAK4OPRM1 | |
| SCHEMBL1369727 | 0.84 | PAK4 (1.00) | PAK4OPRM1 | |
| SCHEMBL1369729 | 0.84 | PAK4 (1.00) | PAK4OPRM1 | |
| SCHEMBL1942571 | 0.82 | PAK4 (0.80) | PAK4PRKCBPLK4CHEK1AURKA | |
| SCHEMBL1941057 | 0.81 | PAK4 (1.00) | PAK4PRKCBPLK4CHEK1AURKA | |
| SCHEMBL3503797 | 0.81 | PAK4 (1.00) | PAK4PRKCBPLK4CHEK1AURKA | |
| SCHEMBL1941053 | 0.80 | PAK4 (0.71) | PAK4OPRM1PRKCBPLK4CHEK1 | |
| SCHEMBL1941054 | 0.79 | PAK4 (0.66) | PAK4OPRM1PRKCBPLK4CHEK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113557017-A | Inhibitors of cyclin-dependent kinase 7 and uses thereof | 达纳-法伯癌症研究所股份有限公司 | 2021-10-26 | — | — | CN | disclosed |