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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Diethylamine SCHEMBL29089953 | 0.90 | MCL1 (0.44) | MCL1TP53DPP4FFAR3 | |
| Diethylamine SCHEMBL28291695 | 0.86 | TP53 (0.57) | MCL1TP53FFAR3 | |
| Diethylamine SCHEMBL1791990 | 0.83 | TP53 (0.53) | MCL1TP53 | |
| Diethylamine SCHEMBL2522638 | 0.83 | — | — | |
| Diethylamine SCHEMBL5874292 | 0.83 | TP53 (0.61) | MCL1TP53FFAR3 | |
| Diethylamine SCHEMBL4340639 | 0.83 | — | — | |
| Diethylamine SCHEMBL1985592 | 0.83 | — | — | |
| Diethylamine SCHEMBL5142450 | 0.80 | TP53 (0.50) | MCL1TP53 | |
| Bicarbonate SCHEMBL4592112 | 0.80 | — | — | |
| Bicarbonate SCHEMBL21598431 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109668976-A | A method of with the related substance of high effective liquid chromatography for measuring dapoxetine hydrochloride | 华控创新（北京）药物研究院有限公司 | 2019-04-23 | — | — | CN | disclosed |