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 | |
|---|---|---|---|---|
| SCHEMBL893383 | 0.84 | CYP3A4 (0.55) | CYP3A4TDP1 | |
| SCHEMBL893198 | 0.84 | CYP3A4 (0.55) | CYP3A4TDP1 | |
| SCHEMBL2919212 | 0.84 | TDP1 (0.50) | CYP3A4TDP1 | |
| Hydrochloric Acid SCHEMBL7389969 | 0.83 | CYP3A4 (0.55) | CYP3A4TDP1 | |
| Hydrochloric Acid SCHEMBL31236647 | 0.83 | CYP3A4 (0.55) | CYP3A4TDP1 | |
| SCHEMBL7196078 | 0.83 | CYP3A4 (0.54) | CYP3A4TDP1 | |
| SCHEMBL7181197 | 0.83 | CYP3A4 (0.54) | CYP3A4TDP1 | |
| SCHEMBL9064880 | 0.80 | CYP3A4 (0.61) | CYP3A4 | |
| SCHEMBL4677833 | 0.80 | CYP3A4 (0.61) | CYP3A4 | |
| SCHEMBL9065625 | 0.80 | CYP3A4 (0.61) | 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 |
|---|---|---|---|---|---|---|---|
| US-5541334-A | TREATING HIV | ABBOTT LABORATORIES (US) | 1996-07-30 | — | — | US | disclosed |
| US-5541206-A | TREATING HUMAN IMMUNODEFICIENCY VIRUS INFECTION | ABBOTT LABORATORIES (US) | 1996-07-30 | — | — | US | disclosed |