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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 SCHEMBL10691829 | 0.87 | CA2 (0.55) | PSIP1CA2HSD11B1L3MBTL1MAPT | |
| SCHEMBL2454945 | 0.87 | CA2 (0.63) | PSIP1CA2HSD11B1L3MBTL1MAPT | |
| SCHEMBL10688783 | 0.81 | PSIP1 (0.57) | PSIP1HSD11B1L3MBTL1MAPTHDAC1 | |
| Diethylamine SCHEMBL10692375 | 0.80 | PSIP1 (0.47) | PSIP1HSD11B1L3MBTL1MAPTHDAC1 | |
| Hydrochloric Acid SCHEMBL10688779 | 0.80 | PSIP1 (0.55) | PSIP1HSD11B1L3MBTL1MAPTHDAC1 | |
| SCHEMBL5664467 | 0.79 | CA2 (0.60) | PSIP1CA2HSD11B1L3MBTL1MAPT | |
| Diethylamine SCHEMBL5874415 | 0.77 | SMN1; SMN2 (0.67) | PSIP1CA2HSD11B1KDM4EPOLB | |
| SCHEMBL23877095 | 0.76 | L3MBTL1 (0.56) | PSIP1CA2HSD11B1L3MBTL1MAPT | |
| SCHEMBL9325260 | 0.76 | CA2 (0.78) | CA2MAPTPOLBHTTALDH1A1 | |
| SCHEMBL7207184 | 0.75 | CA2 (0.66) | PSIP1CA2HSD11B1L3MBTL1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4754024-A | Fibre-reactive azo dyes containing vinylsulfonyl or analogous groups | CIBA-GEIGY CORPORATION | 1988-06-28 | — | — | US | disclosed |