Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ERCC5 | P28715 | 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 | |
|---|---|---|---|---|
| SCHEMBL3811253 | 0.88 | CYP3A4 (0.39) | CYP3A4L3MBTL1SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL2157525 | 0.86 | CYP3A4 (0.39) | CYP3A4L3MBTL1SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL3811295 | 0.83 | CYP3A4 (0.39) | CYP3A4L3MBTL1SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL3809084 | 0.80 | CYP1A2 (0.39) | CYP3A4SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL3813315 | 0.78 | FLT1 (0.39) | CYP3A4SMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL3807407 | 0.78 | IKBKB (0.36) | CYP3A4SMN1; SMN2MAPTTSHRCASP1 | |
| SCHEMBL3815114 | 0.77 | SRD5A2 (0.41) | CYP3A4SMN1; SMN2MAPTTSHRCASP1 | |
| SCHEMBL3817609 | 0.77 | CYP3A4 (0.39) | CYP3A4SMN1; SMN2MEN1KMT2AMAPT | |
| SCHEMBL3814717 | 0.76 | AVPR2 (0.35) | CYP3A4L3MBTL1SMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL3812137 | 0.76 | AVPR2 (0.42) | CYP3A4 |
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 |