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 | |
|---|---|---|---|---|
| SCHEMBL12991613 | 0.86 | CYP3A4 (0.59) | CYP3A4 | |
| SCHEMBL2954848 | 0.85 | CYP3A4 (0.62) | CYP3A4 | |
| SCHEMBL893198 | 0.85 | CYP3A4 (0.55) | CYP3A4TDP1 | |
| SCHEMBL893460 | 0.85 | CYP3A4 (0.62) | CYP3A4 | |
| SCHEMBL893383 | 0.85 | CYP3A4 (0.55) | CYP3A4TDP1 | |
| Hydrochloric Acid SCHEMBL7389969 | 0.84 | CYP3A4 (0.55) | CYP3A4TDP1 | |
| SCHEMBL19286627 | 0.84 | CYP3A4 (0.57) | CYP3A4TDP1 | |
| SCHEMBL16281945 | 0.84 | CYP3A4 (0.59) | CYP3A4 | |
| SCHEMBL893784 | 0.84 | CYP3A4 (0.57) | CYP3A4TDP1 | |
| Hydrochloric Acid SCHEMBL31236647 | 0.84 | CYP3A4 (0.55) | CYP3A4TDP1 |
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 |