Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.48 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29053371 | 0.92 | HTR2A (0.49) | TAAR1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL24883650 | 0.82 | TAAR1 (0.53) | TAAR1MAPTTRPM8HTR2AHTR2C | |
| SCHEMBL13974809 | 0.79 | TAAR1 (0.56) | TAAR1HTR2AHTR2CHTR2B | |
| SCHEMBL30101707 | 0.77 | TAAR1 (0.61) | TAAR1MAPTHTR2AHTR2CHTR2B | |
| SCHEMBL25519810 | 0.77 | TAAR1 (0.61) | TAAR1MAPTHTR2AHTR2CHTR2B | |
| SCHEMBL429483 | 0.74 | TAAR1 (0.67) | TAAR1MAPTKDM4ECYP1A2CYP3A4 | |
| SCHEMBL9425573 | 0.74 | TRPM8 (0.64) | TAAR1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL108087 | 0.74 | TAAR1 (0.77) | TAAR1MAPTGAACYP1A2CYP3A4 | |
| SCHEMBL11698777 | 0.74 | HTR2A (0.59) | HTR2AHTR2CHTR2B | |
| Propane SCHEMBL7426260 | 0.73 | CYP3A4 (0.64) | TAAR1MAPTSMN1; SMN2KDM4ETSHR |
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-2023137446-A1 | PRODRUGS OF 3,4-METHYLENEDIOXY- N-ETHYL-AMPHETAMINE (MDEA) AND USES THEREOF | TERRAN BIOSCIENCES INC. (US) | 2023-07-20 | — | — | WO | disclosed |