Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | HRH2 | P25021 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3742695 | 0.80 | CYP1A2 (0.49) | HTR3EHTR3BCHRNA7HTR3AHTR3D | |
| SCHEMBL6925075 | 0.79 | ALDH1A1 (0.49) | OPRM1OPRK1NPC1TDP1MAPT | |
| SCHEMBL6925072 | 0.79 | ALDH1A1 (0.49) | OPRM1OPRK1NPC1TDP1MAPT | |
| SCHEMBL6789647 | 0.78 | TDP1 (0.42) | CHRM2DRD2HTR2AHTR2COPRM1 | |
| SCHEMBL3759811 | 0.77 | CHRNB4 (0.50) | HTR3EHTR3BCHRNA7HTR3AHTR3D | |
| SCHEMBL1573787 | 0.77 | CHRNB4 (0.50) | HTR3EHTR3BCHRNA7HTR3AHTR3D | |
| SCHEMBL7227680 | 0.77 | CHRNB4 (0.50) | HTR3EHTR3BCHRNA7HTR3AHTR3D | |
| SCHEMBL3748640 | 0.76 | HTR3E (0.45) | HTR3EHTR3BCHRNA7HTR3AHTR3D | |
| SCHEMBL13045214 | 0.76 | HTR3E (0.45) | HTR3EHTR3BCHRNA7HTR3AHTR3D | |
| SCHEMBL13078569 | 0.74 | PDE4A (0.48) | HTR3EHTR3BCHRNA7HTR3AHTR3D |
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-2011018796-A1 | AN IMPROVED PROCESS FOR THE SYNTHESIS OF ALKYL/ARALKYL (2S)-2-(TERT-BUTOXYCARBONYL)-AMINO-2-[-8-AZABICYCLO[3.2.1]OCT-3-YL]-EXO-ACETATE AND ANALOGS THEREOF: KEY INTERMEDIATES FOR THE PREPARATION OF DPPIV INHIBITORS | LUPIN LIMITED (IN) | 2011-02-17 | — | — | WO | disclosed |