Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CLK1 | P49759 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15093305 | 1.00 | CYP3A4 (0.55) | CYP3A4NPC1CLK1RAB9A | |
| SCHEMBL15093303 | 1.00 | CYP3A4 (0.55) | CYP3A4NPC1CLK1RAB9A | |
| SCHEMBL15093977 | 0.94 | CYP3A4 (0.63) | CYP3A4 | |
| SCHEMBL15093806 | 0.94 | CYP3A4 (0.63) | CYP3A4 | |
| SCHEMBL15093329 | 0.94 | CYP3A4 (0.63) | CYP3A4 | |
| SCHEMBL3323072 | 0.93 | CYP3A4 (0.63) | CYP3A4NPC1CLK1RAB9A | |
| SCHEMBL15102826 | 0.89 | CYP3A4 (0.61) | CYP3A4 | |
| SCHEMBL15093577 | 0.89 | CYP3A4 (0.61) | CYP3A4 | |
| SCHEMBL15099808 | 0.89 | CYP3A4 (0.58) | CYP3A4NPC1CLK1RAB9A | |
| SCHEMBL15093597 | 0.88 | CYP3A4 (0.65) | 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 |
|---|---|---|---|---|---|---|---|
| WO-2013103724-A1 | 2- (TERT - BUTOXY) -2- (7 -METHYLQUINOLIN- 6 - YL) ACETIC ACID DERIVATIVES FOR TREATING AIDS | GILEAD SCIENCES, INC. (US) | 2013-07-11 | — | — | WO | disclosed |