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 | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.56 |
| ▸ | BCL2L1 | Q07817 | 3/20 | 0.56 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.52 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.49 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.49 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | MMP9 | P14780 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL366081 | 0.94 | MAOA (0.63) | MAOAMAOBBCL2L1MCL1NPC1 | |
| SCHEMBL365210 | 0.94 | MAOA (0.63) | MAOAMAOBBCL2L1MCL1NPC1 | |
| Diethylamine SCHEMBL16239678 | 0.90 | RXRA (0.57) | BCL2L1MCL1NPC1RAB9ASCN9A | |
| Diethylamine SCHEMBL16239601 | 0.88 | HDAC3 (0.58) | MAOBBCL2L1MCL1NPC1RAB9A | |
| Diethylamine SCHEMBL16239962 | 0.86 | RXRA (0.58) | MAOAMAOBBCL2L1MCL1NPC1 | |
| SCHEMBL364340 | 0.85 | RXRA (0.62) | BCL2L1MCL1NPC1RAB9ANR4A2 | |
| Diethylamine SCHEMBL16239865 | 0.84 | MRGPRX4 (0.58) | SCN9ASCN5AKMT2ASMN1; SMN2 | |
| SCHEMBL367348 | 0.83 | BCL2L1 (0.57) | MAOAMAOBBCL2L1MCL1NPC1 | |
| SCHEMBL16239768 | 0.82 | ALDH1A1 (0.70) | BCL2L1MCL1NPC1RAB9ASCN9A | |
| SCHEMBL365645 | 0.82 | ALDH1A1 (0.70) | BCL2L1MCL1NPC1RAB9ASCN9A |
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 |