Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 7/20 | 0.48 |
| ▸ | HSD17B1 | P14061 | 5/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 5/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6429088 | 0.85 | GPBAR1 (0.50) | GPBAR1HSD17B1HSD17B2KIF11HDAC6 | |
| SCHEMBL3812673 | 0.84 | GPBAR1 (0.41) | GPBAR1HSD17B1HSD17B2HDAC6HDAC1 | |
| SCHEMBL3816560 | 0.80 | HSD17B1 (0.44) | HSD17B1HSD17B2 | |
| SCHEMBL3811162 | 0.80 | GPBAR1 (0.44) | GPBAR1 | |
| SCHEMBL3816953 | 0.80 | NR1H4 (0.41) | HSD17B1HSD17B2 | |
| SCHEMBL3817190 | 0.80 | NTRK1 (0.43) | GPBAR1HSD17B1HSD17B2 | |
| SCHEMBL3811484 | 0.79 | ACLY (0.43) | — | |
| SCHEMBL3809493 | 0.79 | HSD17B1 (0.39) | HSD17B1HSD17B2 | |
| SCHEMBL3811638 | 0.79 | MAPT (0.45) | HSD17B1HSD17B2 | |
| SCHEMBL3816846 | 0.78 | IKBKB (0.38) | HSD17B1HSD17B2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1401825-B1 | THIOPHENE DERIVATIVES AS ANTIVIRAL AGENTS FOR FLAVIVIRUS INFECTION | VIROCHEM PHARMA INC (CA) | 2009-08-05 | — | — | EP | claimed |