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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | LOX | P28300 | 1/20 | 0.30 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.30 |
| ▸ | LOXL2 | Q9Y4K0 | 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 SCHEMBL80173 | 0.85 | — | — | |
| Diethylamine SCHEMBL28822393 | 0.85 | — | — | |
| Propylamine SCHEMBL28012633 | 0.85 | — | — | |
| Diethylamine SCHEMBL9339061 | 0.82 | TP53 (0.50) | TP53TSHR | |
| Diethylamine SCHEMBL11359408 | 0.82 | TP53 (0.57) | TP53TSHR | |
| SCHEMBL28092602 | 0.81 | CYP2C19 (0.46) | TP53TSHR | |
| Diethylamine SCHEMBL27661029 | 0.76 | — | — | |
| Diethylamine SCHEMBL19615022 | 0.75 | TP53 (0.67) | TP53TSHR | |
| Diethylamine SCHEMBL4738312 | 0.75 | — | — | |
| Diethylamine SCHEMBL8427492 | 0.73 | — | — |
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-102701895-A | Method for extracting and separating liquid olefin and alkane mixture by adopting functional ionic liquid | UNIV ZHEJIANG | 2012-10-03 | — | — | CN | claimed |
| CN-102701895-A | Method for extracting and separating liquid olefin and alkane mixture by adopting functional ionic liquid | UNIV ZHEJIANG | 2012-10-03 | — | — | CN | disclosed |