Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25591601 | 0.83 | — | — | |
| SCHEMBL25823774 | 0.78 | HCRTR1 (0.35) | ALDH1A1LMNACYP2A6CYP2A13TSHR | |
| SCHEMBL25815995 | 0.69 | KDM4E (0.31) | LMNASMN1; SMN2 | |
| SCHEMBL25816627 | 0.64 | HTR2A (0.37) | ALDH1A1 | |
| SCHEMBL19070853 | 0.63 | CYP2A6 (0.42) | ALDH1A1LMNASMN1; SMN2CYP2A6CYP2A13 | |
| SCHEMBL25595351 | 0.63 | HRH1 (0.32) | ALDH1A1LMNA | |
| SCHEMBL25669745 | 0.63 | CYP1A2 (0.41) | ALDH1A1LMNAMAPT | |
| SCHEMBL12315699 | 0.62 | HTR1A (0.40) | ALDH1A1SMN1; SMN2CYP2A6CYP2A13TSHR | |
| SCHEMBL22910898 | 0.60 | ALDH1A1 (0.36) | ALDH1A1LMNASMN1; SMN2MAPT | |
| SCHEMBL598666 | 0.60 | CYP2A6 (0.46) | ALDH1A1CYP2A6CYP2A13TSHR |
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-2023125944-A1 | COMPOUND CONTAINING HETEROCYCLIC RING | 正大天晴药业集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |