Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 4/20 | 0.60 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.60 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.60 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.44 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.44 |
| ▸ | CHRNG | P07510 | 2/20 | 0.44 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.44 |
| ▸ | CHRND | Q07001 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL159004 | 0.83 | ADRA2A (0.50) | ADRA2AADRA2BADRA2CALDH1A1MAOA | |
| Methyl Alcohol SCHEMBL11023364 | 0.80 | ADRA2A (0.51) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL8137336 | 0.80 | POLB (0.64) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL4744924 | 0.78 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CALDH1A1MAOA | |
| SCHEMBL17722365 | 0.76 | ADRA2A (1.00) | ADRA2AADRA2BADRA2CMAOAMAOB | |
| SCHEMBL8554047 | 0.76 | SLC6A2 (0.51) | ADRA2AADRA2BADRA2CSLC6A2SLC6A4 | |
| SCHEMBL23646289 | 0.75 | ADRA1D (0.57) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL2216120 | 0.74 | TSHR (0.49) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL20541087 | 0.74 | CYP2A6 (0.70) | ADRA2CPOLBPTGS2CYP3A4CYP2A6 | |
| SCHEMBL30026143 | 0.74 | CYP2A6 (0.70) | ADRA2CPOLBPTGS2CYP3A4CYP2A6 |
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-1099692-B1 | N,N-SUBSTITUTED CYCLIC AMINE DERIVATIVES | EISAI CO LTD (JP) | 2006-05-03 | — | — | EP | disclosed |