Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | GLI1 | P08151 | 1/20 | 0.33 |
| ▸ | GLI2 | P10070 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13039615 | 0.77 | CYP3A4 (0.37) | CYP3A4GLI1GLI2NOS3NOS2 | |
| SCHEMBL900857 | 0.76 | CYP3A4 (0.36) | CYP3A4CYP19A1GLI1GLI2NOS3 | |
| SCHEMBL12411067 | 0.76 | CYP3A4 (0.36) | CYP3A4CYP19A1GLI1GLI2NOS3 | |
| SCHEMBL4265777 | 0.71 | CYP3A4 (0.33) | CYP3A4NOS3NOS2 | |
| SCHEMBL900679 | 0.71 | CYP19A1 (0.35) | CYP3A4CYP19A1 | |
| SCHEMBL4275329 | 0.71 | CYP3A4 (0.33) | CYP3A4 | |
| SCHEMBL4266508 | 0.71 | CYP3A4 (0.33) | CYP3A4 | |
| SCHEMBL4270147 | 0.71 | CYP3A4 (0.33) | CYP3A4 | |
| SCHEMBL4273330 | 0.69 | CYP3A4 (0.33) | CYP3A4 | |
| SCHEMBL4275086 | 0.69 | CYP3A4 (0.35) | 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 |
|---|---|---|---|---|---|---|---|
| US-4081458-A | NON-STEROIDAL BENZOPYRANOXANTHENONES | ELI LILLY AND COMPANY (US) | 1978-03-28 | — | — | US | disclosed |