Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | ACHE | P22303 | 4/20 | 0.59 |
| ▸ | HTR6 | P50406 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.52 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.52 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.52 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | HTR1A | P08908 | 2/20 | 0.51 |
| ▸ | HTR2B | P41595 | 2/20 | 0.51 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.51 |
| ▸ | HTR3B | O95264 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | HTR1D | P28221 | 1/20 | 0.51 |
| ▸ | HTR1B | P28222 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL25173275 | 1.00 | KDM4E (0.60) | KDM4EACHEHTR6KMT2AMTNR1A | |
| SCHEMBL24723324 | 0.92 | KDM4E (0.65) | KDM4EACHEHTR6KMT2AMTNR1A | |
| SCHEMBL29992041 | 0.82 | KDM4E (0.73) | KDM4EHTR6KMT2AMTNR1AMTNR1B | |
| SCHEMBL29993218 | 0.82 | KDM4E (0.73) | KDM4EHTR6KMT2AMTNR1AMTNR1B | |
| SCHEMBL24496999 | 0.82 | KDM4E (0.73) | KDM4EHTR6KMT2AMTNR1AMTNR1B | |
| SCHEMBL24723375 | 0.82 | KDM4E (0.66) | KDM4EACHEHTR6KMT2AMTNR1A | |
| SCHEMBL25491588 | 0.81 | ICMT (0.52) | HTR6KMT2AMTNR1AMTNR1BHTR1A | |
| SCHEMBL25169836 | 0.81 | CDK4 (0.61) | KMT2ANPSR1MEN1ALDH1A1RAB9A | |
| SCHEMBL25172585 | 0.79 | HTR6 (0.85) | ACHEHTR6KMT2AMTNR1AMTNR1B | |
| SCHEMBL30370317 | 0.79 | HTR6 (0.85) | ACHEHTR6KMT2AMTNR1AMTNR1B |
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-4423061-A1 | NOVEL BENZYLTRYPTAMINE COMPOUNDS | Reunion Neuroscience, Inc. (US) | 2024-09-04 | — | — | EP | disclosed |
| CN-118382614-A | Novel benzyl tryptamine compounds | 瑞安神经科学公司 | 2024-07-23 | — | — | CN | disclosed |
| WO-2023070228-A1 | NOVEL BENZYLTRYPTAMINE COMPOUNDS | REUNION NEUROSCIENCE CANADA INC. (CA) | 2023-05-04 | — | — | WO | disclosed |