Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 6/20 | 0.34 |
| ▸ | HTR3A | P46098 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.34 |
| ▸ | HTR3B | O95264 | 1/20 | 0.34 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.34 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.30 |
| ▸ | MMP8 | P22894 | 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 | |
|---|---|---|---|---|
| SCHEMBL14369951 | 0.77 | ADRA1A (0.37) | ADRA1AHTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL12082646 | 0.77 | ADRA1A (0.37) | ADRA1AHTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL12082749 | 0.77 | ADRA1A (0.37) | ADRA1AHTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL9582496 | 0.74 | HTR3A (0.38) | ADRA1AHTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL21515924 | 0.74 | HTR3A (0.38) | ADRA1AHTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL9582692 | 0.74 | HTR3A (0.38) | ADRA1AHTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL9582228 | 0.74 | HTR3A (0.38) | ADRA1AHTR3AADRA2AADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL9582939 | 0.73 | HTR3A (0.37) | ADRA1AHTR3AADRA2AADRA2BADRA2C | |
| SCHEMBL9582888 | 0.71 | PSEN1 (0.39) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| SCHEMBL9581650 | 0.71 | MMP8 (0.41) | ADRA1AHTR3AADRA2AADRA2BADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-3925667-A1 | SELECTIVE TMPRSS2 INHIBITORS AND MEDICAL USE THEREOF | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2021-12-22 | — | — | EP | disclosed |