Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL894139 | 0.89 | CYP3A4 (0.53) | CYP3A4 | |
| SCHEMBL893483 | 0.85 | TDP1 (0.50) | CYP3A4CYP2D6 | |
| SCHEMBL4248588 | 0.84 | CYP3A4 (0.49) | CYP3A4CYP2D6 | |
| SCHEMBL4251990 | 0.84 | CYP3A4 (0.61) | CYP3A4CYP2D6 | |
| SCHEMBL4251351 | 0.82 | CYP3A4 (0.44) | CYP3A4CYP2D6 | |
| SCHEMBL893562 | 0.81 | CYP3A4 (0.51) | CYP3A4CYP2D6 | |
| SCHEMBL4251180 | 0.81 | CYP3A4 (0.49) | CYP3A4CYP2D6 | |
| SCHEMBL4959397 | 0.80 | CYP3A4 (0.56) | CYP3A4 | |
| SCHEMBL4959571 | 0.80 | CYP3A4 (0.56) | CYP3A4 | |
| SCHEMBL4390521 | 0.80 | CYP3A4 (0.56) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2081917-A2 | CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF | Abbott Laboratories (US) | 2009-07-29 | — | — | EP | disclosed |
| WO-2008027932-A2 | CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF | ABBOTT LABORATORIES (US) | 2008-03-06 | — | — | WO | disclosed |