Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.36 |
| ▸ | CDK4 | P11802 | 3/20 | 0.33 |
| ▸ | CCND1 | P24385 | 3/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | PLK1 | P53350 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | CHUK | O15111 | 1/20 | 0.32 |
| ▸ | IKBKG | Q9Y6K9 | 1/20 | 0.32 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.32 |
| ▸ | SYK | P43405 | 2/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650631 | 0.93 | EGFR (0.43) | EGFRCDK2PLK1MKNK1MKNK2 | |
| SCHEMBL22650781 | 0.91 | IKBKB (0.39) | EGFRCDK4CCND1CCNA2CDK2 | |
| SCHEMBL22650574 | 0.89 | CDK4 (0.43) | CDK4CCND1CCNA2CDK2CCNA1 | |
| SCHEMBL22650532 | 0.83 | EGFR (0.36) | EGFRCDK4CCND1MKNK1MKNK2 | |
| SCHEMBL22650624 | 0.82 | EGFR (0.34) | EGFR | |
| SCHEMBL22650858 | 0.79 | CDK4 (0.41) | CDK4CCND1CCNA2CDK2CCNA1 | |
| SCHEMBL22650578 | 0.79 | IKBKB (0.35) | EGFRCCNA2CDK2CCNA1IKBKB | |
| SCHEMBL22650625 | 0.78 | EGFR (0.43) | EGFRCDK4CCND1CDK2 | |
| SCHEMBL22650779 | 0.78 | CDK6 (0.42) | CDK4CCND1CCNA2CDK2CCNA1 | |
| SCHEMBL22650597 | 0.78 | EGFR (0.37) | EGFRCDK4CCND1CCNA2CDK2 |
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-2020224568-A1 | CDK INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2020-11-12 | — | — | WO | disclosed |