Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3134479 | 0.77 | PTGS2 (0.38) | CYP1A2 | |
| SCHEMBL3129684 | 0.72 | ALDH1A1 (0.46) | CYP1A2 | |
| SCHEMBL19043840 | 0.68 | CYP1A2 (0.58) | CYP1A2 | |
| SCHEMBL30926615 | 0.59 | CYP1A2 (0.65) | CYP1A2 | |
| SCHEMBL19452835 | 0.54 | — | — | |
| SCHEMBL13227370 | 0.54 | — | — | |
| SCHEMBL30405624 | 0.53 | — | — | |
| SCHEMBL19448937 | 0.51 | NPC1 (0.36) | — | |
| SCHEMBL8266614 | 0.51 | — | — | |
| SCHEMBL7009362 | 0.49 | — | — |
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-7625888-B2 | Fused triazole derivatives as dipeptidyl peptidase-IV inhibitors for the treatment or prevention of diabetes | MERCK & CO., INC. (US) | 2009-12-01 | — | — | US | disclosed |