Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.57 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.33 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.33 |
| ▸ | OXTR | P30559 | 1/20 | 0.33 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28153626 | 0.82 | ADRB2 (0.37) | ADRB2 | |
| SCHEMBL28146267 | 0.79 | CYP1A2 (0.46) | CYP2A6SLC6A7POLBNPC1RAB9A | |
| SCHEMBL10162103 | 0.77 | ADRB2 (0.63) | ADRB2CLK4CYP2A6CYP3A4SLC6A7 | |
| SCHEMBL533651 | 0.77 | ADRB2 (0.63) | ADRB2CLK4CYP2A6AOC3RIPK1 | |
| SCHEMBL28051298 | 0.75 | MKNK1 (0.54) | ADRB2NPC1RAB9AMKNK1MKNK2 | |
| SCHEMBL27635339 | 0.75 | ADRB2 (0.33) | ADRB2RIPK1MEN1KMT2AMKNK1 | |
| SCHEMBL28179882 | 0.75 | MAPT (0.48) | CLK4CYP3A4NPC1RAB9ADYRK1A | |
| SCHEMBL6685962 | 0.75 | CLK4 (0.64) | ADRB2CLK4CYP2A6AOC3CYP3A4 | |
| SCHEMBL28997882 | 0.75 | ALDH1A1 (0.31) | — | |
| SCHEMBL27850508 | 0.74 | TAAR1 (0.50) | MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-109942556-A | Pyrimidinone compound and its application | 上海青煜医药科技有限公司 | 2019-06-28 | — | — | CN | disclosed |