Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SNCA | P37840 | 1/20 | 0.50 |
| ▸ | HSD17B1 | P14061 | 11/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 11/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL19741486 | 0.86 | HSD17B1 (0.56) | HSD17B1HSD17B2ALDH1A1CNR1MEN1 | |
| SCHEMBL28164110 | 0.82 | SNCA (0.50) | SNCAHSD17B1HSD17B2ALDH1A1PGR | |
| SCHEMBL10455681 | 0.82 | HSD17B1 (0.59) | HSD17B1HSD17B2ALDH1A1CNR1MEN1 | |
| SCHEMBL9196846 | 0.80 | SNCA (0.53) | SNCAHSD17B1HSD17B2ALDH1A1PGR | |
| SCHEMBL147294 | 0.80 | HSD17B1 (0.49) | HSD17B1HSD17B2ALDH1A1PGRCNR1 | |
| SCHEMBL1773166 | 0.79 | SNCA (0.52) | SNCAHSD17B1HSD17B2ALDH1A1PGR | |
| SCHEMBL1773393 | 0.79 | SNCA (0.50) | SNCAHSD17B1HSD17B2ALDH1A1MAPK1 | |
| SCHEMBL12529379 | 0.77 | HSD17B1 (0.47) | HSD17B1HSD17B2ALDH1A1CNR1MEN1 | |
| SCHEMBL9429775 | 0.77 | ALDH1A1 (0.50) | HSD17B1HSD17B2ALDH1A1CNR1MEN1 | |
| SCHEMBL4138621 | 0.77 | HSD17B1 (0.59) | HSD17B1HSD17B2ALDH1A1PGRCNR1 |
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-108602834-B | Bruton's tyrosine kinase inhibitor | 北京盛诺基医药科技股份有限公司 | 2021-01-08 | — | — | CN | disclosed |