Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.46 |
| ▸ | BLM | P54132 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | APP | P05067 | 2/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL16042250 | 1.00 | AHR (0.46) | AHRBLMLMNAMAPTHTT | |
| SCHEMBL24988229 | 0.83 | BLM (0.42) | AHRBLMLMNAMAPTHTT | |
| SCHEMBL20741917 | 0.80 | LMNA (0.48) | AHRBLMLMNAMAPTHTT | |
| SCHEMBL3356952 | 0.75 | MAPT (0.39) | MAPTHTTCYP1A2CASP1CA2 | |
| SCHEMBL5545052 | 0.75 | TUBB4A (0.33) | SLC5A2 | |
| SCHEMBL11209169 | 0.75 | CYP3A4 (0.47) | MAPTHPGDMAOBCYP3A4SLC5A2 | |
| SCHEMBL13975336 | 0.75 | SLC5A2 (0.31) | SLC5A2 | |
| SCHEMBL8930712 | 0.74 | TUBB4A (0.35) | — | |
| SCHEMBL11392234 | 0.71 | ALDH1A1 (0.52) | TSHRTDP1 | |
| SCHEMBL15911961 | 0.71 | PARP1 (0.41) | LMNAMAPTCYP1A2SLC5A2 |
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-4370114-A2 | NOVEL SHORT-ACTING PSYCHOACTIVE COMPOUNDS OF THE MDMA CLASS | Mydecine Innovations Group Inc. (US) | 2024-05-22 | — | — | EP | disclosed |
| WO-2023288013-A2 | NOVEL SHORT-ACTING PSYCHOACTIVE COMPOUNDS OF THE MDMA CLASS | MYDECINE INNOVATIONS GROUP INC. (US) | 2023-01-19 | — | — | WO | disclosed |