Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 4/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4968152 | 0.81 | CYP1A2 (0.62) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11573309 | 0.80 | OPRK1 (0.64) | OPRK1OPRM1OPRD1TAAR1BCHE | |
| SCHEMBL3749579 | 0.80 | OPRK1 (0.59) | OPRK1OPRM1OPRD1TAAR1BCHE | |
| SCHEMBL8058897 | 0.80 | GAA (0.47) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL2831864 | 0.78 | OPRK1 (0.60) | OPRK1OPRM1OPRD1TAAR1BCHE | |
| Bromide SCHEMBL10656516 | 0.78 | OPRK1 (0.57) | OPRK1OPRM1OPRD1TAAR1BCHE | |
| SCHEMBL30575763 | 0.78 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28651481 | 0.77 | TAAR1 (0.45) | OPRK1OPRM1OPRD1TAAR1BCHE | |
| SCHEMBL4727500 | 0.77 | KMT2A (0.53) | CYP1A2OPRK1OPRM1OPRD1ALOX5 | |
| Hydrochloric Acid SCHEMBL11773955 | 0.76 | OPRM1 (0.45) | OPRK1OPRM1OPRD1TAAR1BCHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116947686-B | N-aryl-N-alkyl-O-allylhydroxylamine compound and synthesis method thereof | 安徽中烟工业有限责任公司 | 2025-06-13 | — | — | CN | disclosed |
| CN-116947686-A | N-aryl-N-alkyl-O-allylhydroxylamine compound and synthesis method thereof | 安徽中烟工业有限责任公司 | 2023-10-27 | — | — | CN | disclosed |