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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 SCHEMBL30789030 | 1.00 | TP53 (0.57) | TP53CYP2C19MEN1GLAKMT2A | |
| Diethylamine SCHEMBL19615008 | 1.00 | — | — | |
| Diethylamine SCHEMBL27873848 | 0.97 | TP53 (0.53) | TP53CYP2C19MEN1GLAKMT2A | |
| Diethylamine SCHEMBL27866605 | 0.97 | TP53 (0.53) | TP53CYP2C19MEN1GLAKMT2A | |
| Diethylamine SCHEMBL27513484 | 0.97 | TP53 (0.53) | TP53CYP2C19MEN1GLAKMT2A | |
| Diethylamine SCHEMBL27866606 | 0.84 | TP53 (0.47) | TP53CYP2C19MEN1GLAKMT2A | |
| Phosphonic Acid SCHEMBL11580983 | 0.82 | TSHR (0.46) | TP53CYP2C19MEN1GLAKMT2A | |
| Diethylamine SCHEMBL29452965 | 0.81 | — | — | |
| Diethylamine SCHEMBL27836291 | 0.81 | — | — | |
| Diethylamine SCHEMBL27919421 | 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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200317976-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | MONASH UNIVERSITY (AU) | 2020-10-08 | — | — | US | claimed |
| EP-3458539-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | Monash University (AU) | 2019-03-27 | — | — | EP | claimed |
| WO-2017197438-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | MONASH UNIVERSITY (AU) | 2017-11-23 | — | — | WO | claimed |
| US-20200317976-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | MONASH UNIVERSITY (AU) | 2020-10-08 | — | — | US | disclosed |
| EP-3458539-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | Monash University (AU) | 2019-03-27 | — | — | EP | disclosed |
| WO-2017197438-A1 | NOVEL PHASE CHANGE MATERIAL AND METHODS OF USE | MONASH UNIVERSITY (AU) | 2017-11-23 | — | — | WO | disclosed |
| CN-101336265-B | Water insoluble additive for improving conductivity of an ion exchange membrane | BDF IP HOLDINGS LTD | 2012-11-07 | — | — | CN | disclosed |
| CN-102656233-A | Functionalized matrices for nanostructure dispersion | NANOSYS INC | 2012-09-05 | — | — | CN | disclosed |
| CN-102320950-A | Method for synthesizing acetic acid through carbonylation | SHANGHAI HUAYI GROUP CO | 2012-01-18 | — | — | CN | disclosed |