Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.42 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 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 | |
|---|---|---|---|---|
| SCHEMBL31038304 | 0.80 | TP53 (0.54) | CHEK1TP53SMN1; SMN2POLBLMNA | |
| SCHEMBL25229814 | 0.80 | TP53 (0.54) | CHEK1TP53SMN1; SMN2POLBLMNA | |
| SCHEMBL14686719 | 0.80 | TP53 (0.51) | CHEK1TP53SMN1; SMN2POLBLMNA | |
| SCHEMBL31079461 | 0.76 | POLB (0.55) | TP53SMN1; SMN2CA1CA2CA6 | |
| SCHEMBL25424710 | 0.76 | POLB (0.55) | TP53SMN1; SMN2CA1CA2CA6 | |
| SCHEMBL12445262 | 0.75 | LMNA (0.60) | TP53CA1CA2CA6OPRK1 | |
| SCHEMBL12445151 | 0.75 | CA1 (0.47) | TP53CA1CA2CA6OPRK1 | |
| SCHEMBL23705839 | 0.73 | ALDH1A1 (0.55) | SMN1; SMN2LMNA | |
| SCHEMBL31091978 | 0.73 | ALDH1A1 (0.55) | SMN1; SMN2LMNA | |
| SCHEMBL2360208 | 0.73 | TP53 (0.45) | CHEK1TP53SMN1; SMN2 |
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-117069724-A | Fused ring compounds, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-17 | — | — | CN | disclosed |