Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK11 | Q15759 | 1/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 9/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 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 | |
|---|---|---|---|---|
| SCHEMBL3812119 | 0.91 | GPBAR1 (0.42) | GPBAR1HSD17B1HSD17B2 | |
| SCHEMBL3811967 | 0.87 | GPBAR1 (0.38) | GPBAR1HSD17B1HSD17B2NPSR1 | |
| SCHEMBL3816560 | 0.85 | HSD17B1 (0.44) | HSD17B1HSD17B2POLB | |
| SCHEMBL2158034 | 0.84 | MAPK11 (0.41) | MAPK11GPBAR1HSD17B1HSD17B2TUBB4A | |
| SCHEMBL3811062 | 0.83 | HSD17B1 (0.43) | HSD17B1HSD17B2POLB | |
| SCHEMBL3812315 | 0.82 | MAPT (0.40) | HSD17B1HSD17B2 | |
| SCHEMBL3807545 | 0.82 | HSD17B1 (0.46) | HSD17B1HSD17B2 | |
| SCHEMBL3809473 | 0.80 | HSD17B1 (0.49) | HSD17B1HSD17B2 | |
| SCHEMBL3811484 | 0.80 | ACLY (0.43) | — | |
| SCHEMBL3816965 | 0.80 | KDM4E (0.43) | POLBNPSR1 |
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 |