Known targets — ChEMBL curated mechanism
CDK1CDK10CDK11BCDK12CDK13CDK14CDK15CDK16CDK17CDK18CDK19CDK2CDK20CDK3CDK4CDK5CDK6CDK7CDK8CDK9
The experimentally established mechanism targets of At-7519. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 known ✓ | Q00535 | 3/20 | 0.66 |
| ▸ | CDK9 known ✓ | P50750 | 2/20 | 0.66 |
| ▸ | CDK14 known ✓ | O94921 | 10/20 | 0.62 |
| ▸ | CDK2 known ✓ | P24941 | 7/20 | 0.62 |
| ▸ | CDK4 known ✓ | P11802 | 2/20 | 0.62 |
| ▸ | CDK1 known ✓ | P06493 | 2/20 | 0.62 |
| ▸ | CDK11B known ✓ | P21127 | 1/20 | 0.62 |
| ▸ | CDK7 known ✓ | P50613 | 1/20 | 0.62 |
| ▸ | CDK3 known ✓ | Q00526 | 1/20 | 0.62 |
| ▸ | CDK6 known ✓ | Q00534 | 1/20 | 0.62 |
| ▸ | CDK16 known ✓ | Q00536 | 1/20 | 0.62 |
| ▸ | CDK17 known ✓ | Q00537 | 1/20 | 0.62 |
| ▸ | CDK18 known ✓ | Q07002 | 1/20 | 0.62 |
| ▸ | CDK13 known ✓ | Q14004 | 1/20 | 0.62 |
| ▸ | CDK15 known ✓ | Q96Q40 | 1/20 | 0.62 |
| ▸ | CDK19 known ✓ | Q9BWU1 | 1/20 | 0.62 |
| ▸ | CDK12 known ✓ | Q9NYV4 | 1/20 | 0.62 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.66 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.66 |
| ▸ | CCNY | Q8ND76 | 10/20 | 0.62 |
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 | |
|---|---|---|---|---|
| At-7519 SCHEMBL955568 | 0.99 | CDK5 (0.67) | CDK5CCNT1CDK9CDK5R1CDK14 | |
| At-7519 SCHEMBL953647 | 0.98 | CDK5 (0.66) | CDK5CCNT1CDK9CDK5R1CDK14 | |
| At-7519 SCHEMBL1069453 | 0.95 | CDK5 (0.62) | CDK5CCNT1CDK9CDK5R1CDK14 | |
| At-7519 SCHEMBL1072294 | 0.94 | CDK5 (0.61) | CDK5CCNT1CDK9CDK5R1CDK14 | |
| At-7519 SCHEMBL16318377 | 0.94 | CDK5 (0.61) | CDK5CCNT1CDK9CDK5R1CDK14 | |
| SCHEMBL8044614 | 0.93 | CDK5 (0.60) | CDK5CCNT1CDK9CDK5R1CDK14 | |
| SCHEMBL1286740 | 0.92 | CDK2 (0.67) | CDK5CCNT1CDK9CDK5R1CDK14 | |
| SCHEMBL1286739 | 0.88 | CDK5 (0.53) | CDK5CCNT1CDK9CDK5R1CDK14 | |
| SCHEMBL13993691 | 0.87 | CDK5 (0.52) | CDK5CCNT1CDK9CDK5R1CDK14 | |
| SCHEMBL13993707 | 0.87 | CDK5 (0.52) | CDK5CCNT1CDK9CDK5R1CDK14 |
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-114008058-B | Prodrugs of CDK inhibitors for the treatment of cancer | 润佳（苏州）医药科技有限公司 | 2024-07-05 | — | — | CN | disclosed |