Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | POLQ | O75417 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL3816512 | 0.87 | IKBKB (0.39) | GAAHSD17B1HSD17B2L3MBTL1KDM4E | |
| SCHEMBL3814669 | 0.87 | NTRK1 (0.43) | NTRK1GAACYP11B1CYP11B2SMN1; SMN2 | |
| SCHEMBL2157421 | 0.85 | NTRK1 (0.45) | NTRK1GAAGPBAR1HSD17B1HSD17B2 | |
| SCHEMBL3812673 | 0.84 | GPBAR1 (0.41) | GPBAR1HSD17B1HSD17B2 | |
| SCHEMBL3808987 | 0.80 | HSD17B1 (0.39) | NTRK1GAAHSD17B1HSD17B2SMN1; SMN2 | |
| SCHEMBL3809513 | 0.80 | GPBAR1 (0.48) | GPBAR1HSD17B1HSD17B2 | |
| SCHEMBL3816846 | 0.78 | IKBKB (0.38) | GAAHSD17B1HSD17B2SMN1; SMN2KDM4E | |
| SCHEMBL3817235 | 0.78 | HSD17B1 (0.45) | GAAHSD17B1HSD17B2SMN1; SMN2L3MBTL1 | |
| SCHEMBL3807569 | 0.78 | HSD17B1 (0.45) | HSD17B1HSD17B2 | |
| SCHEMBL3816953 | 0.78 | NR1H4 (0.41) | HSD17B1HSD17B2L3MBTL1KDM4E |
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 |