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 | |
|---|---|---|---|---|
| SCHEMBL4251958 | 0.88 | CYP3A4 (0.52) | CYP3A4TDP1 | |
| SCHEMBL893245 | 0.88 | CYP3A4 (0.48) | CYP3A4TDP1 | |
| SCHEMBL4248671 | 0.83 | CYP3A4 (0.49) | CYP3A4 | |
| SCHEMBL4253503 | 0.81 | CYP3A4 (0.46) | CYP3A4 | |
| SCHEMBL4248157 | 0.81 | CYP3A4 (0.48) | CYP3A4 | |
| SCHEMBL4248623 | 0.76 | CYP3A4 (0.45) | CYP3A4 | |
| SCHEMBL3015198 | 0.75 | TDP1 (0.48) | CYP3A4TDP1 | |
| SCHEMBL27738871 | 0.75 | CYP3A4 (0.67) | CYP3A4 | |
| SCHEMBL27738870 | 0.75 | CYP3A4 (0.67) | CYP3A4 | |
| SCHEMBL893198 | 0.75 | 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 |