Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE1 | P24864 | 6/20 | 0.43 |
| ▸ | CDK2 | P24941 | 6/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25347566 | 1.00 | CCNE1 (0.43) | CCNE1CDK2GAACYP3A4CYP2C19 | |
| SCHEMBL31059705 | 0.86 | CCNE1 (0.58) | CCNE1CDK2GAACYP3A4CYP2C19 | |
| SCHEMBL30545929 | 0.86 | CCNE1 (0.58) | CCNE1CDK2GAACYP3A4CYP2C19 | |
| SCHEMBL26039843 | 0.86 | CCNE1 (0.35) | CCNE1CDK2GAACYP3A4CYP2C19 | |
| SCHEMBL26039789 | 0.83 | CCNE1 (0.38) | CCNE1CDK2GAACYP3A4CYP2C19 | |
| SCHEMBL25348135 | 0.82 | GAA (0.47) | CCNE1CDK2GAACYP3A4CYP2C19 | |
| SCHEMBL25348173 | 0.82 | GAA (0.47) | CCNE1CDK2GAACYP3A4CYP2C19 | |
| SCHEMBL25348594 | 0.82 | GAA (0.47) | CCNE1CDK2GAACYP3A4CYP2C19 | |
| SCHEMBL31059621 | 0.82 | GAA (0.47) | CCNE1CDK2GAACYP3A4CYP2C19 | |
| SCHEMBL25348590 | 0.82 | GAA (0.47) | CCNE1CDK2GAACYP3A4CYP2C19 |
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-2024178335-A2 | NOVEL MACROCYCLIC AMINOPYRAZOLE COMPOUNDS AS CDK2 INHIBITORS | ACCUTAR BIOTECHNOLOGY, INC. (US) | 2024-08-29 | — | — | WO | disclosed |