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 | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | HNF4A | P41235 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | HEXA | P06865 | 1/20 | 0.37 |
| ▸ | HEXB | P07686 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL192418 | 0.82 | ALDH1A1 (0.50) | PDCD1CD274DPP4HNF4AHTT | |
| Propionaldehyde SCHEMBL27763213 | 0.82 | PDCD1 (0.40) | ADRB2SMN1; SMN2PDCD1CD274DPP4 | |
| Methyl Alcohol SCHEMBL27488232 | 0.80 | ALDH1A1 (0.50) | SMN1; SMN2PDCD1CD274HNF4AHTT | |
| SCHEMBL27608314 | 0.80 | ALDH1A1 (0.44) | SMN1; SMN2PDCD1CD274DPP4HNF4A | |
| SCHEMBL28995730 | 0.79 | ALDH1A1 (0.48) | PDCD1CD274DPP4HNF4AHTT | |
| SCHEMBL2806539 | 0.79 | ALDH1A1 (0.48) | PDCD1CD274DPP4HNF4AHTT | |
| Water SCHEMBL432858 | 0.79 | ALDH1A1 (0.48) | PDCD1CD274DPP4HNF4AHTT | |
| Ammonia Solution, Strong SCHEMBL21647364 | 0.79 | ALDH1A1 (0.48) | PDCD1CD274DPP4HNF4AHTT | |
| Charcoal, Activated SCHEMBL30690883 | 0.79 | ALDH1A1 (0.48) | PDCD1CD274DPP4HNF4AHTT | |
| SCHEMBL29093087 | 0.79 | ALDH1A1 (0.48) | PDCD1CD274DPP4HNF4AHTT |
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-0350984-A1 | Electrophotographic recording material containing a trisazo dye | AGFA-GEVAERT N.V. (BE) | 1990-01-17 | — | — | EP | disclosed |