Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 4/20 | 0.47 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.47 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 2/20 | 0.40 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.40 |
| ▸ | SYK | P43405 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.40 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.40 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30648761 | 0.88 | CDK5 (0.46) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL26640913 | 0.88 | CDK5 (0.46) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL26640875 | 0.87 | NEK2 (0.46) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL27054171 | 0.86 | CDK5 (0.49) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL26640775 | 0.85 | CDK2 (0.48) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL26640112 | 0.85 | CDK5 (0.48) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL30648703 | 0.85 | CDK5 (0.48) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL26640174 | 0.81 | CDK5 (0.47) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL30648643 | 0.81 | CDK5 (0.45) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL26640389 | 0.81 | CDK5 (0.45) | CDK5CDK5R1CCNA2CDK2GRM5 |
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-2023220541-A1 | TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES COMPOUNDS AS HPK1 INHIBITORS | MERCK PATENT GMBH (DE) | 2023-11-16 | — | — | WO | disclosed |