Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP14 | P50281 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13817698 | 0.83 | EPHX1 (0.35) | SMN1; SMN2GAARAB9AEPHX1TDP1 | |
| SCHEMBL13817799 | 0.79 | TDP1 (0.33) | SMN1; SMN2GAARAB9AEPHX1ALDH1A1 | |
| SCHEMBL6566358 | 0.79 | GABRP (0.45) | ALDH1A1TDP1KMT2A | |
| SCHEMBL6567540 | 0.79 | ALDH1A1 (0.36) | SMN1; SMN2GAARAB9AEPHX1ALDH1A1 | |
| Bicarbonate SCHEMBL10653006 | 0.78 | ALDH1A1 (0.41) | SMN1; SMN2GAARAB9AEPHX1ALDH1A1 | |
| SCHEMBL1226217 | 0.77 | ALDH1A1 (0.44) | SMN1; SMN2EPHX1ALDH1A1TDP1KMT2A | |
| SCHEMBL19270454 | 0.76 | CYP2C19 (0.41) | SMN1; SMN2EPHX1ALDH1A1CYP2C19TDP1 | |
| SCHEMBL3001781 | 0.75 | NAAA (0.46) | EPHX1KMT2A | |
| SCHEMBL2998795 | 0.75 | NAAA (0.46) | EPHX1KMT2A | |
| SCHEMBL22768587 | 0.75 | EPHX1 (0.42) | EPHX1CYP2C19HPGDKMT2A |
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-1737881-B1 | NOVEL COMPOUNDS AS INHIBITORS OF HEPATITIS C VIRUS NS3 SERINE PROTEASE | SCHERING CORP (US) | 2009-06-24 | — | — | EP | disclosed |