Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 2/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.42 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 6/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.39 |
| ▸ | JAK2 | O60674 | 2/20 | 0.38 |
| ▸ | JAK3 | P52333 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 4/20 | 0.38 |
| ▸ | CDK4 | P11802 | 4/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CCND1 | P24385 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | TYK2 | P29597 | 1/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.37 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.37 |
| ▸ | BRD4 | O60885 | 3/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 3/20 | 0.36 |
| ▸ | CSF1R | P07333 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650526 | 0.89 | MAP4K1 (0.44) | IKBKBCHUKCDK9CCNT1JAK2 | |
| SCHEMBL22650432 | 0.88 | CDK6 (0.35) | IKBKBCHUKCDK4CDK1CCNB1 | |
| SCHEMBL22650430 | 0.88 | MYLK4 (0.43) | IKBKBCHUKACVR1CDK9CCNT1 | |
| SCHEMBL22650524 | 0.87 | CDK6 (0.38) | IKBKBCHUKCDK2CDK4CDK1 | |
| SCHEMBL22650939 | 0.87 | CAMK2D (0.44) | IKBKBCHUKCDK9CCNT1JAK2 | |
| SCHEMBL29491175 | 0.83 | CDK4 (0.49) | CDK9CCNT1CDK2CDK4CDK1 | |
| SCHEMBL22650568 | 0.83 | CDK4 (0.49) | CDK9CCNT1CDK2CDK4CDK1 | |
| SCHEMBL22650937 | 0.81 | CDK4 (0.40) | CDK9CCNT1CDK2CDK4CDK1 | |
| SCHEMBL22650485 | 0.79 | CDK4 (0.47) | CDK9CCNT1CDK2CDK4CDK1 | |
| SCHEMBL22650422 | 0.78 | CDK1 (0.41) | CDK9CCNT1JAK2JAK3CDK2 |
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 |