Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.59 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.47 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.47 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.47 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.45 |
| ▸ | PRMT5 | O14744 | 3/20 | 0.45 |
| ▸ | WDR77 | Q9BQA1 | 3/20 | 0.45 |
| ▸ | NAMPT | P43490 | 2/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | DRD5 | P21918 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3693657 | 1.00 | ESR2 (0.59) | ESR2NR1H2MAPK1ABHD6DDB1 | |
| SCHEMBL2129313 | 0.90 | ESR2 (0.53) | ESR2NR1H2MAPK1UCHL1PRMT5 | |
| SCHEMBL1958196 | 0.89 | ESR2 (0.59) | ESR2NR1H2MAPK1ABHD6DDB1 | |
| SCHEMBL30150268 | 0.89 | ESR2 (0.59) | ESR2NR1H2MAPK1ABHD6DDB1 | |
| SCHEMBL19608875 | 0.88 | ESR2 (0.56) | ESR2NR1H2MAPK1ABHD6DDB1 | |
| SCHEMBL15893734 | 0.87 | DDB1 (0.55) | ESR2NR1H2MAPK1ABHD6DDB1 | |
| SCHEMBL4519564 | 0.85 | NR1H2 (0.60) | ESR2NR1H2MAPK1ABHD6DDB1 | |
| SCHEMBL30553398 | 0.85 | NR1H2 (0.60) | ESR2NR1H2MAPK1ABHD6DDB1 | |
| SCHEMBL30207825 | 0.85 | ESR2 (0.54) | ESR2NR1H2MAPK1ABHD6DDB1 | |
| SCHEMBL29734640 | 0.85 | ESR2 (0.54) | ESR2NR1H2MAPK1ABHD6DDB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115594669-B | Parallel ring derivative and preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2024-11-05 | — | — | CN | disclosed |
| CN-116693514-A | Aromatic ring substituted methoxy derivative and application thereof | 上海璎黎药业有限公司 | 2023-09-05 | — | — | CN | disclosed |
| CN-109890797-B | Substituted carbon nucleoside derivatives useful as anticancer agents | 辉瑞公司 | 2023-02-28 | — | — | CN | disclosed |
| CN-115594669-A | Fused ring derivative and preparation method and medical application thereof | 深圳信立泰药业股份有限公司（CN） | 2023-01-13 | — | — | CN | disclosed |