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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| Dimethylamine SCHEMBL1302605 | 0.88 | TSHR (0.53) | TSHRHPGDALDH1A1TP53HIF1A | |
| Trimethylammonium SCHEMBL1301981 | 0.85 | TSHR (0.53) | TSHRHPGDALDH1A1TP53HIF1A | |
| Diethylamine SCHEMBL1302461 | 0.84 | TSHR (0.49) | TSHRHPGDALDH1A1TP53HIF1A | |
| Diethylamine SCHEMBL1302375 | 0.84 | TSHR (0.49) | TSHRHPGDALDH1A1TP53HIF1A | |
| Diethylamine SCHEMBL1303241 | 0.84 | TSHR (0.49) | TSHRHPGDALDH1A1TP53HIF1A | |
| SCHEMBL1302330 | 0.84 | TSHR (0.49) | TSHRHPGDALDH1A1TP53HIF1A | |
| Hydrochloric Acid SCHEMBL9139239 | 0.82 | KDM4E (0.52) | TSHRHPGDALDH1A1TP53HIF1A | |
| SCHEMBL28785943 | 0.77 | TSHR (0.61) | TSHRHPGDALDH1A1TP53HIF1A | |
| SCHEMBL34872 | 0.77 | TSHR (0.61) | TSHRHPGDALDH1A1TP53HIF1A | |
| SCHEMBL27821520 | 0.77 | TSHR (0.61) | TSHRHPGDALDH1A1TP53HIF1A |
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-2387866-A1 | ELECTROMAGNETIC WAVE SHIELDING GEL-LIKE COMPOSITION | 3M Innovative Properties Company (US) | 2011-11-23 | — | — | EP | disclosed |
| US-20110268950-A1 | Electromagnetic Wave Shielding Gel-Like Composition | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2011-11-03 | — | — | US | disclosed |
| US-8038066-B2 | Laser scanner with deformable lens | HAND HELD PRODUCTS, INC. (US) | 2011-10-18 | — | — | US | disclosed |
| WO-2010083075-A1 | ELECTROMAGNETIC WAVE SHIELDING GEL-LIKE COMPOSITION | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2010-07-22 | — | — | WO | disclosed |