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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 SCHEMBL814207 | 1.00 | — | — | |
| Nitric Acid SCHEMBL7118827 | 0.88 | CA5A (0.44) | CA5ACA5BTP53CYP3A4ALOX15 | |
| Nitric Acid SCHEMBL15789388 | 0.82 | CA5A (0.38) | CA5ACA5BTP53CYP3A4ALOX15 | |
| Diethylamine SCHEMBL8669371 | 0.81 | TSHR (0.69) | TP53CYP3A4ALOX15TSHRALDH1A1 | |
| Nitric Acid SCHEMBL974885 | 0.81 | — | — | |
| Methylethylamine SCHEMBL9472991 | 0.81 | — | — | |
| Diethylamine SCHEMBL25341225 | 0.80 | TSHR (0.52) | TSHRALDH1A1CYP2C19MEN1GLA | |
| Nitric Acid SCHEMBL7114903 | 0.80 | CA5A (0.36) | CA5ACA5BTP53CYP3A4ALOX15 | |
| Nitric Acid SCHEMBL8418839 | 0.80 | MEN1 (0.40) | CA5ACA5BTP53CYP3A4ALOX15 | |
| Nitric Acid SCHEMBL2217977 | 0.79 | CA5A (0.67) | CA5ACA5BTSHRALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-118475289-A | Sensor for continuous biological monitor with nitric oxide releasing compound | 艾力汇医疗股份有限公司 | 2024-08-09 | — | — | CN | disclosed |
| US-4386977-A | PETROLEUM WAX AND UREA AS CONTINUOUS PHASE AND AMMONIA NITRATE OXIDIZER AND EMULSIFIER AS DISCONTINUOUS PHASE | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1983-06-07 | — | — | US | disclosed |