Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL733010 | 0.87 | CYP3A4 (0.74) | CYP3A4TSHRP2RY6CYP1A2MAPK1 | |
| SCHEMBL1900351 | 0.83 | CYP3A4 (0.68) | CYP3A4TSHRP2RY6CYP1A2MAPK1 | |
| SCHEMBL93415 | 0.83 | CYP3A4 (0.68) | CYP3A4TSHRP2RY6CYP1A2MAPK1 | |
| SCHEMBL7898757 | 0.83 | CYP3A4 (0.68) | CYP3A4TSHRP2RY6CYP1A2MAPK1 | |
| SCHEMBL11061694 | 0.81 | CYP3A4 (0.65) | CYP3A4TSHRP2RY6CYP1A2MAPK1 | |
| SCHEMBL11723360 | 0.81 | CYP3A4 (0.65) | CYP3A4TSHRP2RY6CYP1A2MAPK1 | |
| SCHEMBL4600058 | 0.79 | CYP3A4 (0.63) | CYP3A4TSHRP2RY6CYP1A2MAPK1 | |
| SCHEMBL27930613 | 0.79 | CYP3A4 (0.63) | CYP3A4TSHRP2RY6CYP1A2MAPK1 | |
| SCHEMBL93144 | 0.79 | CYP3A4 (0.63) | CYP3A4TSHRP2RY6CYP1A2MAPK1 | |
| SCHEMBL19943 | 0.78 | CYP3A4 (1.00) | CYP3A4TSHRP2RY6CYP1A2MAPK1 |
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-2009061131-A2 | NOVEL TRICYCLIC DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | JE IL PHARMACEUTICAL CO., LTD. (KR) | 2009-05-14 | — | — | WO | disclosed |