Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28824752 | 0.84 | SIGMAR1 (0.50) | OPRM1MAPTSIGMAR1 | |
| SCHEMBL28824734 | 0.83 | RORC (0.52) | OPRM1MAPTCYP3A4CYP2D6MAPK1 | |
| SCHEMBL28824755 | 0.79 | LMNA (0.51) | MAPTNR1H2NR1H3SIGMAR1CYP3A4 | |
| SCHEMBL28824750 | 0.79 | OPRM1 (0.44) | OPRM1MAPTNR1H2NR1H3SIGMAR1 | |
| SCHEMBL28824742 | 0.72 | RORC (0.52) | NR1H2NR1H3 | |
| SCHEMBL16226782 | 0.71 | SIGMAR1 (0.55) | NR1H2NR1H3SIGMAR1CYP1A2CYP3A4 | |
| SCHEMBL23870272 | 0.71 | DPP4 (0.56) | SIGMAR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL28824737 | 0.70 | MAPT (0.45) | MAPTSIGMAR1FUCA1 | |
| SCHEMBL24365249 | 0.70 | MAPT (0.56) | OPRM1MAPTNR1H2NR1H3SIGMAR1 | |
| SCHEMBL8659907 | 0.70 | MEN1 (0.65) | SIGMAR1CYP1A2CYP3A4CYP2D6CYP2C9 |
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-114941145-B | Synthesis method of aziridine derivatives | 天津理工大学 | 2023-08-18 | — | — | CN | disclosed |
| CN-114941145-A | Synthetic method of aziridine derivative | 天津理工大学 | 2022-08-26 | — | — | CN | disclosed |