Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 10/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 9/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3808987 | 0.86 | HSD17B1 (0.39) | HSD17B2HSD17B1 | |
| SCHEMBL2157634 | 0.85 | GPBAR1 (0.42) | GPBAR1HSD17B2HSD17B1HDAC6HDAC1 | |
| SCHEMBL3817190 | 0.84 | NTRK1 (0.43) | GPBAR1HSD17B2HSD17B1 | |
| SCHEMBL3809513 | 0.84 | GPBAR1 (0.48) | GPBAR1HSD17B2HSD17B1HDAC6HDAC1 | |
| SCHEMBL3816512 | 0.81 | IKBKB (0.39) | HSD17B2HSD17B1 | |
| SCHEMBL3817235 | 0.78 | HSD17B1 (0.45) | HSD17B2HSD17B1 | |
| SCHEMBL3807569 | 0.78 | HSD17B1 (0.45) | HSD17B2HSD17B1 | |
| SCHEMBL3812250 | 0.77 | HPGD (0.41) | HSD17B2HSD17B1 | |
| SCHEMBL3809712 | 0.77 | POLB (0.50) | HSD17B2HSD17B1 | |
| SCHEMBL3807286 | 0.77 | CYP1A2 (0.41) | GPBAR1 |
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 |