Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 20/20 | 0.49 |
| ▸ | HCRTR2 | O43614 | 20/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 13/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL16766890 | 1.00 | HCRTR1 (0.49) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL14940503 | 1.00 | HCRTR1 (0.49) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL14940506 | 1.00 | HCRTR1 (0.49) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL16767114 | 0.84 | HCRTR1 (0.49) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL16767113 | 0.84 | HCRTR1 (0.49) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL16766769 | 0.82 | HCRTR1 (0.41) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL16766770 | 0.82 | HCRTR1 (0.41) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL17580405 | 0.81 | HCRTR1 (0.48) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL17580406 | 0.81 | HCRTR1 (0.48) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL17580094 | 0.81 | HCRTR1 (0.48) | HCRTR1HCRTR2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110612291-B | Preparation of 2- ([ 1,2,3] triazol-2-yl) -benzoic acid derivatives | 爱杜西亚药品有限公司 | 2024-02-13 | — | — | CN | disclosed |