Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.77 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.77 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.77 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Azapetine SCHEMBL456796 | 0.88 | ADRA1D (1.00) | ADRA1DADRA1AADRA1BCA12CA2 | |
| Azapetine SCHEMBL29763084 | 0.88 | ADRA1D (1.00) | ADRA1DADRA1AADRA1BCA12CA2 | |
| Azapetine SCHEMBL6763929 | 0.86 | ADRA1D (0.96) | ADRA1DADRA1AADRA1BCA12CA2 | |
| Azapetine SCHEMBL5099699 | 0.82 | ADRA1D (0.81) | ADRA1DADRA1AADRA1BCA12CA2 | |
| SCHEMBL2321445 | 0.82 | ADRA1D (0.81) | ADRA1DADRA1AADRA1BLMNAGAA | |
| SCHEMBL23714081 | 0.79 | ADRA1D (0.65) | ADRA1DADRA1AADRA1BCA12CA2 | |
| SCHEMBL4000995 | 0.75 | SIGMAR1 (0.54) | KMT2ASIGMAR1DRD2HTR1ADRD3 | |
| SCHEMBL8227830 | 0.75 | ADRA1D (0.59) | ADRA1DADRA1AADRA1BCA12CA2 | |
| SCHEMBL13268064 | 0.71 | CASP3 (0.51) | ADRA1DADRA1AADRA1BCA12CA2 | |
| SCHEMBL3957205 | 0.70 | ADRA1D (0.62) | ADRA1DADRA1AADRA1BMAOAMAOB |
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-2009005459-A1 | PHENYL-1,2, 3,4-TETRAHYDROISOQUINOLINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF A PAIN DISORDER | ASTRAZENECA AB (SE) | 2009-01-08 | — | — | WO | disclosed |