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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28732539 | 0.83 | TP53 (1.00) | TP53ALDH1A1POLBMAPTNPC1 | |
| SCHEMBL1331033 | 0.83 | — | — | |
| SCHEMBL37253 | 0.83 | — | — | |
| Alcohol SCHEMBL27594550 | 0.81 | — | — | |
| Dimethylamine SCHEMBL28135809 | 0.80 | — | — | |
| Propionaldehyde SCHEMBL27817356 | 0.80 | TP53 (0.65) | TP53ALDH1A1POLBATMMAPT | |
| Methane SCHEMBL25269682 | 0.80 | — | — | |
| Ethane SCHEMBL3670045 | 0.80 | — | — | |
| Water SCHEMBL14353431 | 0.80 | — | — | |
| Hydrogen Sulfide SCHEMBL15020519 | 0.80 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-7330578-A | — | — | None | — | — | JP | disclosed |
| EP-0755671-B1 | DERMATOLOGIC PREPARATION | KAO CORP (JP) | 1998-07-08 | — | — | EP | disclosed |
| EP-0755671-A1 | DERMATOLOGIC PREPARATION | Kao Corporation (JP) | 1997-01-29 | — | — | EP | disclosed |
| JP-H07330578-A | SKIN EXTERNAL AGENT | KAO CORP | 1995-12-19 | — | — | JP | disclosed |