Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.45 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL25533321 | 0.85 | SIGMAR1 (0.46) | SIGMAR1SLC6A4ADRB2ADRB3ADRA1A | |
| SCHEMBL25533176 | 0.85 | SIGMAR1 (0.46) | SIGMAR1SLC6A4ADRB2ADRB3ADRA1A | |
| SCHEMBL14291518 | 0.85 | TAAR1 (0.59) | SIGMAR1SLC6A4ALOX15ALOX12TAAR1 | |
| SCHEMBL896903 | 0.76 | TAAR1 (0.72) | SLC6A4ADRB2ADRB3ADRA1AADRB1 | |
| SCHEMBL30434262 | 0.76 | TAAR1 (0.72) | SLC6A4ADRB2ADRB3ADRA1AADRB1 | |
| SCHEMBL30503037 | 0.76 | TAAR1 (0.72) | SLC6A4ADRB2ADRB3ADRA1AADRB1 | |
| SCHEMBL25188324 | 0.76 | TAAR1 (0.72) | SLC6A4ADRB2ADRB3ADRA1AADRB1 | |
| SCHEMBL715096 | 0.76 | TAAR1 (0.72) | SLC6A4ADRB2ADRB3ADRA1AADRB1 | |
| SCHEMBL29350327 | 0.76 | TAAR1 (0.72) | SLC6A4ADRB2ADRB3ADRA1AADRB1 | |
| Hydrochloric Acid SCHEMBL35210364 | 0.75 | TAAR1 (0.70) | SLC6A4ADRB2ADRB3ADRA1AADRB1 |
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-2023081897-A1 | ISOTOPICALLY ENRICHED 3,4-METHYLENEDIOXY-N-ETHYLAMPHETAMINE (MDE) AND STEREOISOMERS THEREOF | TERRAN BIOSCIENCES, INC. (US) | 2023-05-11 | — | — | WO | disclosed |