Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 3/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.31 |
| ▸ | HTR3B | O95264 | 2/20 | 0.31 |
| ▸ | HTR3A | P46098 | 2/20 | 0.31 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.31 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTR1D | P28221 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1219179 | 0.80 | ADRB1 (0.31) | ADRB1 | |
| SCHEMBL517802 | 0.77 | ADRB1 (0.37) | ADRB1EPHX2ALDH1A1HTR3EHTR3B | |
| SCHEMBL26646496 | 0.74 | ADRB1 (0.35) | ADRB1ALDH1A1HTR3EHTR3BHTR3A | |
| Hydrochloric Acid SCHEMBL12818396 | 0.74 | ALDH1A1 (0.37) | ADRB1ALDH1A1HTR3EHTR3BHTR3A | |
| SCHEMBL20699458 | 0.73 | CYP2B6 (0.31) | — | |
| SCHEMBL28311781 | 0.72 | ADRB1 (0.34) | ADRB1ALDH1A1HTR3EHTR3BHTR3A | |
| Hydrazine SCHEMBL27569857 | 0.72 | ADRB1 (0.34) | ADRB1ALDH1A1HTR3EHTR3BHTR3A | |
| SCHEMBL15313178 | 0.72 | ADRB1 (0.34) | ADRB1ALDH1A1HTR3EHTR3BHTR3A | |
| Benzene SCHEMBL27534755 | 0.70 | SIGMAR1 (0.39) | ADRB1EPHX2ALDH1A1HTR3EHTR3B | |
| SCHEMBL918508 | 0.69 | ALDH1A1 (0.43) | ADRB1EPHX2ALDH1A1HTR3EHTR3B |
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-108713018-B | Amine-containing cyclic hydrofluoroethers and methods of use thereof | 3M创新有限公司 | 2022-07-05 | — | — | CN | disclosed |