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 | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 3/20 | 0.33 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.32 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.31 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.30 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL24837945 | 0.88 | LOXL2 (0.38) | MAP2K1MAP2K2LOXL2PYCR1FFAR1 | |
| SCHEMBL15491228 | 0.78 | FFAR1 (0.38) | MAP2K1MAP2K2PYCR1FFAR1FFAR4 | |
| SCHEMBL27854622 | 0.74 | LOXL2 (0.37) | MAP2K1MAP2K2LOXL2 | |
| SCHEMBL16286817 | 0.73 | PARP1 (0.36) | MAP2K1MAP2K2LOXL2PYCR1FFAR1 | |
| SCHEMBL18235903 | 0.72 | LMNA (0.38) | LOXL2 | |
| SCHEMBL27864802 | 0.72 | MAP2K1 (0.33) | MAP2K1MAP2K2PYCR1FFAR1FFAR4 | |
| SCHEMBL1164841 | 0.71 | POLB (0.43) | PYCR1FFAR1FFAR4 | |
| SCHEMBL1164992 | 0.71 | FFAR1 (0.38) | MAP2K1MAP2K2PYCR1FFAR1FFAR4 | |
| SCHEMBL22954538 | 0.71 | LOXL2 (0.37) | LOXL2PYCR1 | |
| SCHEMBL30200755 | 0.71 | LOXL2 (0.37) | LOXL2FFAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102548975-A | Histone deacetylase inhibitors | PORTSMOUTH TECHNOLOGIES LLC | 2012-07-04 | — | — | CN | disclosed |