Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.70 |
| ▸ | NPC1 | O15118 | 4/20 | 0.70 |
| ▸ | LMNA | P02545 | 2/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.70 |
| ▸ | HPGD | P15428 | 1/20 | 0.70 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.64 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.56 |
| ▸ | WNT3A | P56704 | 1/20 | 0.56 |
| ▸ | EDNRB | P24530 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL389405 | 0.89 | SMN1; SMN2 (0.66) | RAB9ANPC1LMNASMN1; SMN2HPGD | |
| SCHEMBL14518414 | 0.86 | ALDH1A1 (0.70) | RAB9ANPC1LMNASMN1; SMN2HPGD | |
| SCHEMBL25231300 | 0.86 | CTNNB1 (0.73) | RAB9ANPC1LMNASMN1; SMN2HPGD | |
| SCHEMBL28482204 | 0.85 | ALDH1A1 (0.56) | RAB9ANPC1LMNASMN1; SMN2HPGD | |
| SCHEMBL11694008 | 0.85 | TDP1 (0.65) | RAB9ANPC1LMNASMN1; SMN2HPGD | |
| SCHEMBL11696819 | 0.85 | KMT2A (0.59) | RAB9ANPC1LMNASMN1; SMN2HPGD | |
| SCHEMBL7812122 | 0.84 | KMT2A (0.60) | RAB9ANPC1LMNASMN1; SMN2HPGD | |
| SCHEMBL109197 | 0.84 | ALDH1A1 (0.64) | RAB9ANPC1LMNASMN1; SMN2HPGD | |
| SCHEMBL7404248 | 0.84 | EDNRB (0.61) | RAB9ANPC1LMNASMN1; SMN2HPGD | |
| SCHEMBL15979976 | 0.83 | CTNNB1 (0.78) | RAB9ANPC1LMNASMN1; SMN2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4436964-A1 | ANALOGUES OF MDMA FOR MODULATING SERT, DAT, AND / OR NET ACTIVITY | The University Of Western Australia (AU) | 2024-10-02 | — | — | EP | disclosed |
| WO-2023092195-A1 | ANALOGUES OF MDMA FOR MODULATING SERT, DAT, AND / OR NET ACTIVITY | THE UNIVERSITY OF WESTERN AUSTRALIA (AU) | 2023-06-01 | — | — | WO | disclosed |
| WO-2023092195-A1 | ANALOGUES OF MDMA FOR MODULATING SERT, DAT, AND / OR NET ACTIVITY | THE UNIVERSITY OF WESTERN AUSTRALIA (AU) | 2023-06-01 | — | — | WO | disclosed |