Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 2/20 | 0.43 |
| ▸ | DRD5 | P21918 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.34 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL22953349 | 0.88 | ADRA2A (0.44) | DRD1DRD5ADRA2ADRD2ADRA2B | |
| SCHEMBL22953352 | 0.88 | ADRA2A (0.44) | DRD1DRD5ADRA2ADRD2ADRA2B | |
| SCHEMBL22952998 | 0.88 | ADRA2A (0.46) | DRD1DRD5ADRA2ADRD2ADRA2B | |
| SCHEMBL22953350 | 0.87 | ESR1 (0.35) | DRD1DRD5ADRA2ADRD2ADRA2B | |
| SCHEMBL22953348 | 0.86 | ADRA2A (0.44) | DRD1DRD5ADRA2ADRD2ADRA2B | |
| SCHEMBL22953347 | 0.86 | ADRA2A (0.44) | DRD1DRD5ADRA2ADRD2ADRA2B | |
| SCHEMBL22953351 | 0.83 | ADRA2A (0.42) | DRD1DRD5ADRA2ADRD2ADRA2B | |
| SCHEMBL22953000 | 0.83 | ADRA2A (0.49) | DRD1DRD5ADRA2ADRD2ADRA2B | |
| SCHEMBL22952936 | 0.80 | DRD1 (0.63) | DRD1DRD5ADRA2ADRD2ADRA2B | |
| SCHEMBL25308161 | 0.69 | PDE4B (0.51) | TLR9TLR8TLR7HTR6 |
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-2021021922-A1 | COMPOUNDS AND METHODS FOR TREATING FIBROTIC PATHOLOGIES | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2021-02-04 | — | — | WO | disclosed |