Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 10/20 | 0.52 |
| ▸ | IKBKB | O14920 | 6/20 | 0.51 |
| ▸ | GSK3B | P49841 | 3/20 | 0.51 |
| ▸ | DKK1 | O94907 | 2/20 | 0.51 |
| ▸ | CDK4 | P11802 | 6/20 | 0.51 |
| ▸ | CDK1 | P06493 | 4/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.51 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.51 |
| ▸ | CDK9 | P50750 | 3/20 | 0.51 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.51 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.51 |
| ▸ | CDK7 | P50613 | 2/20 | 0.51 |
| ▸ | CCNH | P51946 | 2/20 | 0.51 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.51 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.51 |
| ▸ | CCND1 | P24385 | 2/20 | 0.51 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.51 |
| ▸ | CCND3 | P30281 | 1/20 | 0.51 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.51 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650537 | 0.84 | CDK2 (0.50) | CDK2IKBKBGSK3BDKK1CDK4 | |
| SCHEMBL6605944 | 0.79 | CDK2 (0.60) | CDK2IKBKBGSK3BDKK1CDK4 | |
| SCHEMBL4822550 | 0.79 | CDK2 (0.63) | CDK2IKBKBGSK3BDKK1CDK4 | |
| SCHEMBL22650625 | 0.75 | EGFR (0.43) | CDK2CDK4CDK1CCNB1CCND1 | |
| SCHEMBL22650362 | 0.74 | CDK4 (0.36) | CDK2CDK4CDK1CCNB1CDK9 | |
| SCHEMBL22650575 | 0.71 | CDK4 (0.57) | CDK2CDK4CDK1CCNB1CCNT1 | |
| SCHEMBL29491163 | 0.70 | CDK4 (0.46) | CDK2GSK3BCDK4CDK1CCNB1 | |
| SCHEMBL22650886 | 0.70 | CDK4 (0.46) | CDK2GSK3BCDK4CDK1CCNB1 | |
| SCHEMBL22650780 | 0.69 | CDK4 (0.54) | CDK2CDK4CDK1CCNB1CCNT1 | |
| SCHEMBL3524241 | 0.69 | IKBKB (0.61) | CDK2IKBKBGSK3BDKK1CDK4 |
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 |