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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL208487 | 0.88 | CES1 (0.54) | CES2CES1AKR1B1MEN1KMT2A | |
| Ethylene SCHEMBL6400163 | 0.86 | CES1 (0.52) | CES2CES1AKR1B1MEN1KMT2A | |
| Phenylacetic Acid SCHEMBL27940832 | 0.78 | AKR1B1 (0.71) | CES2CES1AKR1B1MEN1KMT2A | |
| Allylamine SCHEMBL29174382 | 0.77 | CES1 (0.42) | CES2CES1AKR1B1MEN1KMT2A | |
| SCHEMBL446675 | 0.77 | MAPT (0.51) | MEN1KMT2APOLBEPHX2HPGD | |
| E1501 SCHEMBL28508045 | 0.76 | ALDH1A1 (0.67) | KMT2A | |
| SCHEMBL8680610 | 0.76 | CES1 (0.45) | CES2CES1AKR1B1MEN1KMT2A | |
| SCHEMBL31114527 | 0.73 | SRD5A2 (0.55) | EPHX2 | |
| SCHEMBL20326368 | 0.73 | CES1 (0.56) | CES2CES1AKR1B1MEN1KMT2A | |
| SCHEMBL10880029 | 0.73 | CTBP2 (0.46) | KMT2AHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006134788-A1 | POSITIVE CHARGE CONTROL RESIN FOR ELECTROPHOTOGRAPHIC FUNCTIONAL COMPONENT PARTS, DEVELOPING ROLLER, AND ELECTROPHOTOGRAPHIC APPARATUS | CANON KASEI KABUSHIKI KAISHA (JP) | 2006-12-21 | — | — | WO | disclosed |