Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ANO1 | Q5XXA6 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2837609 | 0.92 | ANO1 (0.55) | ALDH1A1ANO1KDM4ELMNAHTT | |
| SCHEMBL16114278 | 0.84 | ALDH1A1 (0.42) | ALDH1A1ANO1CYP3A4CYP2C8KCNH2 | |
| SCHEMBL6841580 | 0.83 | ANO1 (0.43) | ANO1CYP3A4KCNH2CYP2C9CYP2C19 | |
| SCHEMBL16114356 | 0.83 | CYP3A4 (0.39) | ALDH1A1ANO1CYP3A4CYP2C8KCNH2 | |
| SCHEMBL2843645 | 0.82 | KDM4E (0.59) | ALDH1A1ANO1SMN1; SMN2KDM4EMEN1 | |
| SCHEMBL16112837 | 0.81 | CYP3A4 (0.40) | ALDH1A1CYP3A4CYP2C8KCNH2CYP2C9 | |
| SCHEMBL18809405 | 0.80 | CYP3A4 (0.44) | ANO1CYP3A4CYP2C8KCNH2CNR1 | |
| SCHEMBL16113732 | 0.79 | CYP3A4 (0.44) | CYP3A4KCNH2CYP2C9CYP2C19 | |
| SCHEMBL1918391 | 0.78 | KDM4E (0.59) | ALDH1A1ANO1KDM4EMEN1LMNA | |
| SCHEMBL18809672 | 0.78 | CYP3A4 (0.46) | CYP3A4CYP2C8KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2970174-A1 | FUSED FURANS FOR THE TREATMENT OF HEPATITIS C | Bristol-Myers Squibb Company (US) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014159559-A1 | FUSED FURANS FOR THE TREATMENT OF HEPATITIS C | BRISTOL-MYERS SQUIBB COMPANY (US) | 2014-10-02 | — | — | WO | disclosed |