Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | PIM1 | P11309 | 1/20 | 0.52 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.47 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.47 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.44 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.42 |
| ▸ | ALDH1A3 | P47895 | 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 | |
|---|---|---|---|---|
| SCHEMBL31031658 | 0.83 | MAOB (0.42) | CYP2A6PIM1GRIN1GRIN2AGRIN2B | |
| SCHEMBL14231754 | 0.77 | NPC1 (0.61) | CYP2A6PIM1GRIN1GRIN2AGRIN2B | |
| SCHEMBL16426150 | 0.77 | CYP2A6 (0.57) | CYP2A6PIM1GRIN1GRIN2AGRIN2B | |
| SCHEMBL29883416 | 0.77 | CYP2A6 (0.57) | CYP2A6PIM1GRIN1GRIN2AGRIN2B | |
| SCHEMBL23920139 | 0.74 | MAOB (0.55) | GPR35CA12CA1CA2CA9 | |
| SCHEMBL18003606 | 0.74 | CA12 (0.46) | CYP2A6CA12CA1CA2CA9 | |
| SCHEMBL12778679 | 0.74 | FLT3 (0.55) | CA2MAOARAB9ANPC1ALDH1A1 | |
| SCHEMBL14754139 | 0.74 | ALDH1A1 (0.52) | CYP2A6CA12CA1CA2CA9 | |
| SCHEMBL3928306 | 0.74 | CYP2A6 (0.53) | CYP2A6PIM1GRIN1GRIN2AGRIN2B | |
| SCHEMBL29608860 | 0.74 | CYP2A6 (0.53) | CYP2A6PIM1GRIN1GRIN2AGRIN2B |
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-2010047372-A1 | 2-AMINOPYRIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVE BOTH HAVING BACE1-INHIBITING ACTIVITY | 塩野義製薬株式会社 (JP) | 2010-04-29 | — | — | WO | disclosed |