Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9900648 | 0.85 | CYP3A4 (0.41) | CYP3A4CYP2C8KCNH2ANO1 | |
| SCHEMBL9899869 | 0.85 | CYP3A4 (0.40) | CYP3A4CYP2C8KCNH2 | |
| SCHEMBL3537382 | 0.83 | L3MBTL1 (0.41) | CYP3A4CYP2C8KCNH2ANO1 | |
| SCHEMBL1919109 | 0.81 | CYP3A4 (0.44) | CYP3A4CYP2C8KCNH2ANO1 | |
| SCHEMBL27822384 | 0.81 | POLB (0.45) | CYP3A4CYP2C8KCNH2 | |
| SCHEMBL14217309 | 0.80 | CYP3A4 (0.49) | CYP3A4CYP2C8KCNH2 | |
| SCHEMBL13457680 | 0.80 | CYP3A4 (0.41) | CYP3A4CYP2C8KCNH2 | |
| SCHEMBL17100003 | 0.80 | CYP3A4 (0.36) | CYP3A4CYP2C8KCNH2 | |
| SCHEMBL17099992 | 0.79 | CYP3A4 (0.43) | CYP3A4CYP2C8KCNH2 | |
| SCHEMBL1918838 | 0.79 | CYP3A4 (0.41) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012078545-A1 | BENZOFURANE DERIVATIVES FOR THE TREATMENT OF HEPATITITS C | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-06-14 | — | — | WO | disclosed |