Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Diethylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.57 |
| ▸ | RXRB | P28702 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.48 |
| ▸ | BCL2L1 | Q07817 | 3/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.46 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL364340 | 0.95 | RXRA (0.62) | RXRARXRBMAPTALDH1A1MAPK1 | |
| Diethylamine SCHEMBL16239880 | 0.90 | MAOA (0.56) | MAPTALDH1A1MAPK1HTTNPC1 | |
| Diethylamine SCHEMBL16239601 | 0.90 | HDAC3 (0.58) | MAPTALDH1A1NPC1RAB9AMEN1 | |
| Diethylamine SCHEMBL16240278 | 0.85 | RXRA (0.45) | RXRARXRBMAPTALDH1A1MAPK1 | |
| Diethylamine SCHEMBL16239787 | 0.84 | SCN9A (0.46) | RXRARXRBMAPK1SCN9A | |
| SCHEMBL365645 | 0.84 | ALDH1A1 (0.70) | MAPTALDH1A1MAPK1HTTNPC1 | |
| SCHEMBL16239768 | 0.84 | ALDH1A1 (0.70) | MAPTALDH1A1MAPK1HTTNPC1 | |
| Diethylamine SCHEMBL16239822 | 0.84 | HDAC8 (0.48) | RXRARXRBALDH1A1MEN1KMT2A | |
| SCHEMBL365210 | 0.83 | MAOA (0.63) | MAPTALDH1A1MAPK1HTTNPC1 | |
| SCHEMBL366812 | 0.83 | MAOB (0.63) | MAPTALDH1A1MAPK1HTTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2593428-B1 | N-SULFONYLBENZAMIDES AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS | PFIZER LTD (GB) | 2014-11-19 | — | — | EP | disclosed |