Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A12 | P48065 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PRSS12 | P56730 | 1/20 | 0.33 |
| ▸ | NPY1R | P25929 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2157463 | 0.89 | SMN1; SMN2 (0.41) | NPC1RAB9APRSS12CYP3A4 | |
| SCHEMBL3815964 | 0.85 | SLC6A12 (0.34) | SLC6A12NPC1RAB9A | |
| SCHEMBL12395525 | 0.84 | SMN1; SMN2 (0.39) | NPC1RAB9ACYP3A4 | |
| SCHEMBL2158409 | 0.84 | NPY1R (0.36) | SLC6A12PRSS12NPY1RCYP3A4 | |
| SCHEMBL3808991 | 0.83 | SLC6A12 (0.33) | SLC6A12NPC1RAB9A | |
| SCHEMBL3812649 | 0.82 | CYP2E1 (0.38) | — | |
| SCHEMBL2158340 | 0.82 | SMN1; SMN2 (0.40) | NPC1RAB9ACYP3A4 | |
| SCHEMBL2157539 | 0.81 | CHRM1 (0.43) | — | |
| SCHEMBL2158000 | 0.78 | EPHX2 (0.36) | SLC6A12NPY1RCYP3A4 | |
| SCHEMBL3134583 | 0.78 | MAPT (0.40) | SLC6A12NPC1RAB9ANPY1R |
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 |