Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.43 |
| ▸ | CDK2 | P24941 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 4/20 | 0.37 |
| ▸ | QRFPR | Q96P65 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | IGF1R | P08069 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30643145 | 1.00 | ESR2 (0.50) | ESR2NR1H2CDK2MAPTAURKA | |
| SCHEMBL2303422 | 0.74 | CDK4 (0.51) | CDK2AURKACDK4CDK1 | |
| SCHEMBL26637834 | 0.73 | CDK4 (0.41) | CDK2CDK4CDK1 | |
| SCHEMBL30368378 | 0.73 | ESR2 (0.67) | ESR2NR1H2MAPTHDAC1 | |
| SCHEMBL30301704 | 0.73 | ESR2 (0.67) | ESR2NR1H2MAPTHDAC1 | |
| SCHEMBL2304507 | 0.71 | CDK4 (0.47) | CDK2CDK4HDAC1CDK1 | |
| SCHEMBL26638064 | 0.71 | CDK4 (0.41) | CDK2CDK4CDK1 | |
| SCHEMBL12518355 | 0.70 | ESR2 (0.55) | ESR2NR1H2CDK2MAPTIGF1R | |
| SCHEMBL31621670 | 0.70 | ESR2 (0.78) | ESR2NR1H2LMNATP53HDAC1 | |
| SCHEMBL19684692 | 0.70 | ESR2 (0.78) | ESR2NR1H2LMNATP53HDAC1 |
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-119156389-A | Heterocyclic compounds, compositions thereof and methods of treatment thereof | 百济神州有限公司 | 2024-12-17 | — | — | CN | disclosed |