Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A12 | P48065 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | UBE2M | P61081 | 2/20 | 0.33 |
| ▸ | DCUN1D1 | Q96GG9 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 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 | |
|---|---|---|---|---|
| SCHEMBL2157968 | 0.90 | SMN1; SMN2 (0.40) | NPC1RAB9ACCR1 | |
| SCHEMBL3811676 | 0.85 | SLC6A12 (0.35) | SLC6A12NPC1RAB9A | |
| SCHEMBL2157585 | 0.84 | MCHR1 (0.34) | — | |
| SCHEMBL3808991 | 0.83 | SLC6A12 (0.33) | SLC6A12ALDH1A1NPC1RAB9A | |
| SCHEMBL3811190 | 0.81 | MAPT (0.33) | SLC6A12ALDH1A1NPC1RAB9APTGDR2 | |
| SCHEMBL2157684 | 0.80 | SLC6A2 (0.43) | — | |
| SCHEMBL2157477 | 0.78 | NPC1 (0.39) | ALDH1A1NPC1RAB9A | |
| SCHEMBL2158749 | 0.77 | CYP3A4 (0.40) | ALDH1A1NPC1RAB9A | |
| SCHEMBL2158689 | 0.76 | CYP1A2 (0.40) | — | |
| SCHEMBL14048989 | 0.76 | CYP3A4 (0.39) | ALDH1A1NPC1RAB9A |
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 |