Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Diethylaniline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CNR2 | P34972 | 4/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.47 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ESRRG | P62508 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Diethylaniline SCHEMBL10699604 | 0.86 | TSHR (0.64) | TSHRMEN1KMT2ARAB9ANPC1 | |
| Diethylaniline SCHEMBL9000098 | 0.86 | TSHR (0.70) | TSHRMEN1KMT2ARAB9ANPC1 | |
| Diethylaniline SCHEMBL17594 | 0.86 | TSHR (0.70) | TSHRMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL9313842 | 0.86 | TSHR (0.50) | TSHRMEN1KMT2ARAB9ANPC1 | |
| Diethylaniline SCHEMBL11076069 | 0.84 | MEN1 (0.61) | TSHRMEN1KMT2ARAB9ANPC1 | |
| Hydrochloric Acid SCHEMBL9314513 | 0.84 | TSHR (0.48) | TSHRMEN1KMT2ARAB9ANPC1 | |
| Diethylaniline SCHEMBL11443667 | 0.84 | TSHR (0.61) | TSHRMEN1KMT2ARAB9ANPC1 | |
| Diethylaniline SCHEMBL28201804 | 0.84 | TSHR (0.61) | TSHRMEN1KMT2ARAB9ANPC1 | |
| Diethylaniline SCHEMBL28100873 | 0.84 | TSHR (0.61) | TSHRMEN1KMT2ARAB9ANPC1 | |
| Diethylaniline SCHEMBL1920410 | 0.84 | TSHR (0.67) | TSHRMEN1KMT2ARAB9ANPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7754792-B2 | Flame-retardant polyester artificial hair | KANEKA CORPORATION (JP) | 2010-07-13 | — | — | US | disclosed |
| US-20080085957-A1 | Flame-Retardant Polyester Artificial Hair | KANEKA CORPORATION (JP) | 2008-04-10 | — | — | US | disclosed |