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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.37 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL12984366 | 0.92 | ALDH1A1 (0.53) | ALDH1A1ADRB2TP53SMN1; SMN2L3MBTL1 | |
| Biphenyl SCHEMBL27871813 | 0.90 | ALDH1A1 (0.50) | ALDH1A1ADRB2TP53SMN1; SMN2L3MBTL1 | |
| Diethylamine SCHEMBL28949463 | 0.84 | TP53 (0.44) | ADRB2TP53HPGDLMNACYP1A2 | |
| Diethylamine SCHEMBL17065808 | 0.79 | ALDH1A1 (0.65) | ALDH1A1ADRB2TP53SMN1; SMN2L3MBTL1 | |
| Diethylamine SCHEMBL11337598 | 0.79 | NOTUM (0.65) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| Biphenyl SCHEMBL27275890 | 0.78 | ADRB2 (0.50) | ALDH1A1ADRB2SMN1; SMN2L3MBTL1SIGMAR1 | |
| Diethylamine SCHEMBL6700983 | 0.78 | TP53 (0.57) | ADRB2TP53SMN1; SMN2L3MBTL1SIGMAR1 | |
| SCHEMBL4332773 | 0.78 | ALDH1A1 (0.75) | ALDH1A1CRHBPCRHR2NPC1RAB9A | |
| SCHEMBL481505 | 0.78 | ALDH1A1 (0.75) | ALDH1A1CRHBPCRHR2NPC1RAB9A | |
| SCHEMBL8452262 | 0.78 | ALDH1A1 (0.75) | ALDH1A1CRHBPCRHR2NPC1RAB9A |
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-0349034-B1 | Electrophotographic recording material | AGFA GEVAERT NV (BE) | 1994-01-12 | — | — | EP | disclosed |
| US-4923774-A | Layered electrophotographic recording element comprising p-type charge transport compounds | AGFA-GEVAERT, N.V. (BE) | 1990-05-08 | — | — | US | disclosed |
| EP-0349034-A1 | Electrophotographic recording material | AGFA-GEVAERT N.V. (BE) | 1990-01-03 | — | — | EP | disclosed |