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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 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 | |
|---|---|---|---|---|
| SCHEMBL8767265 | 0.92 | HDAC4 (0.44) | HDAC4CYP2D6POLBACAT2PDK2 | |
| SCHEMBL8766538 | 0.83 | ACHE (0.35) | HDAC4ACAT2PDE7ACYP2C9CYP2C19 | |
| SCHEMBL8765847 | 0.79 | HDAC4 (0.44) | HDAC4CYP2D6PDK2GAA | |
| Diethylamine SCHEMBL11103207 | 0.78 | KDM1A (0.42) | CYP2D6KDM1ACYP2C9 | |
| SCHEMBL8766466 | 0.75 | HDAC4 (0.44) | HDAC4CYP2D6PDK2CYP2C9 | |
| SCHEMBL8766383 | 0.73 | HDAC4 (0.56) | HDAC4CYP2D6POLBPDK2PDE7A | |
| SCHEMBL8766329 | 0.73 | HDAC4 (0.39) | HDAC4CYP2D6PDK2GAACYP2C9 | |
| SCHEMBL8766477 | 0.72 | HDAC4 (0.38) | HDAC4CYP2D6 | |
| SCHEMBL8767261 | 0.71 | HDAC4 (0.38) | HDAC4CYP2D6 | |
| SCHEMBL8766110 | 0.71 | HDAC4 (0.38) | HDAC4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0115198-B1 | ELECTROPHOTOGRAPHIC PHOTOCONDUCTIVE ELEMENTS | TOMOEGAWA PAPER MANUFACTURING COMPANY LIMITED (JP) | 1987-03-11 | — | — | EP | disclosed |
| US-4539282-A | SENSITIZED ZINC OXIDE, POLYCARBONATE BINDER AND AROMATIC DIAMINE | TOMOEGAWA PAPER MANUFACTURING COMPANY LIMITED (JP) | 1985-09-03 | — | — | US | disclosed |
| EP-0115198-A1 | Electrophotographic photoconductive elements | TOMOEGAWA PAPER MANUFACTURING COMPANY LIMITED (JP) | 1984-08-08 | — | — | EP | disclosed |
| US-4302521-A | TRANSPORT PHASE OF A P-TYPE ORGANIC SEMICONDUCTOR, POLYVINYLCARBAZOLE, A LEWIS AND A BRONSTED ACID; CHARGE TRANSFER COMPOUNDS | KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) | 1981-11-24 | — | — | US | disclosed |