Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL25895367 | 0.92 | — | — | |
| SCHEMBL132315 | 0.81 | — | — | |
| SCHEMBL9074979 | 0.79 | CYP1A2 (0.38) | TRPA1TRPV1CYP1A2CYP2D6 | |
| SCHEMBL1005697 | 0.78 | NAAA (0.38) | TRPA1TRPV1CYP1A2CYP2D6 | |
| SCHEMBL3626821 | 0.75 | CYP1A2 (0.32) | CYP1A2CYP2D6 | |
| SCHEMBL9064503 | 0.75 | NAAA (0.50) | CYP1A2CYP2D6 | |
| SCHEMBL27916922 | 0.74 | TRPA1 (0.50) | TRPA1TRPV1 | |
| SCHEMBL6720 | 0.74 | — | — | |
| Dimethylamine SCHEMBL8019309 | 0.73 | CYP1A2 (0.34) | TRPA1TRPV1CYP1A2CYP2D6 | |
| SCHEMBL26926038 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012042534-A2 | PROCESSES FOR THE PREPARATION OF R-SITAGLIPTIN AND INTERMEDIATES THEREOF | GLENMARK GENERICS LIMITED (IN) | 2012-04-05 | — | — | WO | claimed |
| WO-2012042534-A2 | PROCESSES FOR THE PREPARATION OF R-SITAGLIPTIN AND INTERMEDIATES THEREOF | GLENMARK GENERICS LIMITED (IN) | 2012-04-05 | — | — | WO | disclosed |