Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 2/20 | 0.52 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.49 |
| ▸ | WNT3A | P56704 | 3/20 | 0.49 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.46 |
| ▸ | PDE2A | O00408 | 3/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.38 |
| ▸ | CHRNG | P07510 | 1/20 | 0.38 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | CHRND | Q07001 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31070402 | 1.00 | HTR1B (0.52) | HTR1BCTNNB1WNT3ASMYD3PDE2A | |
| SCHEMBL25665024 | 0.87 | HTR1B (0.50) | HTR1BCTNNB1WNT3ASMYD3CHRNA1 | |
| SCHEMBL25745352 | 0.85 | HTR1B (0.49) | HTR1BCTNNB1WNT3ASMYD3CHRNA1 | |
| SCHEMBL25745430 | 0.85 | HTR1B (0.49) | HTR1BCTNNB1WNT3ASMYD3CHRNA1 | |
| SCHEMBL11434846 | 0.84 | CTNNB1 (0.54) | CTNNB1WNT3ASMYD3PDE2AADORA3 | |
| SCHEMBL25745310 | 0.84 | HTR1B (0.48) | HTR1BCTNNB1WNT3ASMYD3CHRNA1 | |
| SCHEMBL2358745 | 0.82 | CTNNB1 (0.51) | CTNNB1WNT3ASMYD3PDE2AADORA3 | |
| SCHEMBL31070398 | 0.82 | CTNNB1 (0.51) | CTNNB1WNT3ASMYD3PDE2AADORA3 | |
| SCHEMBL30376331 | 0.78 | SMYD3 (0.57) | CTNNB1WNT3ASMYD3TAS2R8 | |
| SCHEMBL22902082 | 0.78 | SMYD3 (0.53) | CTNNB1WNT3ASMYD3PDE2AADORA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4673127-A1 | DEUTERATED AND FLUORINATED EMPATHOGENS | Alexander Shulgin Research Institute, Inc. (US) | 2026-01-07 | — | — | EP | disclosed |
| WO-2024182774-A1 | DEUTERATED AND FLUORINATED EMPATHOGENS | ALEXANDER SHULGIN RESEARCH INSTITUTE, INC. (US) | 2024-09-06 | — | — | WO | disclosed |