Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 6/20 | 0.50 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.50 |
| ▸ | CDK1 | P06493 | 5/20 | 0.50 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.50 |
| ▸ | CDK9 | P50750 | 5/20 | 0.50 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.50 |
| ▸ | CDK7 | P50613 | 2/20 | 0.50 |
| ▸ | CCNH | P51946 | 2/20 | 0.50 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.50 |
| ▸ | IKBKB | O14920 | 7/20 | 0.49 |
| ▸ | DKK1 | O94907 | 2/20 | 0.49 |
| ▸ | GSK3B | P49841 | 2/20 | 0.49 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.48 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.48 |
| ▸ | CDK4 | P11802 | 2/20 | 0.47 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.45 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.44 |
| ▸ | IGF1R | P08069 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650623 | 0.84 | CDK2 (0.52) | CDK2CCNT1CDK1CCNB1CDK9 | |
| SCHEMBL22650626 | 0.78 | CDK2 (0.39) | CDK2CCNT1CDK1CCNB1CDK9 | |
| SCHEMBL22650630 | 0.78 | CDK9 (0.35) | CDK2CDK1CCNB1CDK9CCNA2 | |
| SCHEMBL22650777 | 0.77 | ACVR1 (0.35) | CDK2CCNT1CDK1CCNB1CDK9 | |
| SCHEMBL22650620 | 0.76 | CDK2 (0.36) | CDK2CDK1CCNB1CDK9CCNA2 | |
| SCHEMBL22650578 | 0.76 | IKBKB (0.35) | CDK2CDK1CCNB1CDK9CCNA2 | |
| SCHEMBL22650781 | 0.75 | IKBKB (0.39) | CDK2CDK1CCNB1CCNA2CCNA1 | |
| SCHEMBL22650536 | 0.75 | JAK2 (0.34) | CDK2CDK1CCNB1CDK9CCNA2 | |
| SCHEMBL22650720 | 0.74 | IKBKB (0.53) | CDK2CCNT1CDK1CCNB1CDK9 | |
| SCHEMBL22650600 | 0.73 | MAPK14 (0.40) | CDK2CDK1CCNA2CCNA1 |
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 |