Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 5/20 | 0.45 |
| ▸ | CDK5R1 | Q15078 | 5/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.45 |
| ▸ | CDK2 | P24941 | 4/20 | 0.45 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.45 |
| ▸ | CCND3 | P30281 | 1/20 | 0.45 |
| ▸ | FLT3 | P36888 | 1/20 | 0.45 |
| ▸ | CDK9 | P50750 | 1/20 | 0.45 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 6/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | MLNR | O43193 | 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 | |
|---|---|---|---|---|
| SCHEMBL26640389 | 1.00 | CDK5 (0.45) | CDK5CDK5R1CCNA2CDK2CCNT1 | |
| SCHEMBL26640174 | 0.89 | CDK5 (0.47) | CDK5CDK5R1CCNA2CDK2CCNT1 | |
| SCHEMBL26640481 | 0.83 | CDK5 (0.43) | CDK5CDK5R1CCNA2CDK2CCNT1 | |
| SCHEMBL26640535 | 0.83 | CDK5 (0.42) | CDK5CDK5R1CCNA2CDK2CCNT1 | |
| SCHEMBL26640895 | 0.83 | CDK5 (0.46) | CDK5CDK5R1CCNA2CDK2CCNT1 | |
| SCHEMBL27054171 | 0.82 | CDK5 (0.49) | CDK5CDK5R1CCNA2CDK2CCNT1 | |
| SCHEMBL30648703 | 0.81 | CDK5 (0.48) | CDK5CDK5R1CCNA2CDK2CDK1 | |
| SCHEMBL26640112 | 0.81 | CDK5 (0.48) | CDK5CDK5R1CCNA2CDK2CDK1 | |
| SCHEMBL26640397 | 0.81 | CDK5 (0.47) | CDK5CDK5R1CCNA2CDK2GRM5 | |
| SCHEMBL26640573 | 0.81 | CDK5 (0.47) | CDK5CDK5R1CCNA2CDK2CCNT1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4522618-A1 | TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES COMPOUNDS AS HPK1 INHIBITORS | Merck Patent GmbH (DE) | 2025-03-19 | — | — | EP | disclosed |
| WO-2023220541-A1 | TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES COMPOUNDS AS HPK1 INHIBITORS | MERCK PATENT GMBH (DE) | 2023-11-16 | — | — | WO | disclosed |