Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | RAMP1 | O60894 | 3/20 | 0.31 |
| ▸ | CALCRL | Q16602 | 3/20 | 0.31 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | REN | P00797 | 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 | |
|---|---|---|---|---|
| SCHEMBL5611990 | 0.89 | RAMP1 (0.34) | RAMP1CALCRLNAMPTREN | |
| SCHEMBL1685531 | 0.86 | CYP3A4 (0.46) | CYP3A4REN | |
| SCHEMBL8243135 | 0.86 | CYP3A4 (0.46) | CYP3A4REN | |
| SCHEMBL3795688 | 0.86 | CYP3A4 (0.46) | CYP3A4REN | |
| SCHEMBL8278256 | 0.82 | REN (0.33) | RAMP1CALCRLNAMPTREN | |
| SCHEMBL13886148 | 0.82 | REN (0.33) | RAMP1CALCRLNAMPTREN | |
| SCHEMBL7866832 | 0.80 | CYP3A4 (0.47) | CYP3A4 | |
| SCHEMBL8378647 | 0.80 | CYP3A4 (0.47) | CYP3A4 | |
| SCHEMBL12844643 | 0.80 | CYP3A4 (0.47) | CYP3A4 | |
| SCHEMBL8172238 | 0.80 | CYP3A4 (0.44) | 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-2305697-A2 | Macrocyclic inhibitors of Hepatitis C virus replication | Intermune, Inc. (US) | 2011-04-06 | — | — | EP | disclosed |