Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D
The experimentally established mechanism targets of Ethylenediamine. 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 | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 6/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| Ethylenediamine SCHEMBL10608603 | 1.00 | CYP1A2 (0.48) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 | |
| SCHEMBL197251 | 0.89 | MAPT (0.52) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 | |
| SCHEMBL153694 | 0.89 | MAPT (0.52) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 | |
| SCHEMBL198241 | 0.89 | MAPT (0.52) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 | |
| SCHEMBL4326795 | 0.89 | MAPT (0.52) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 | |
| SCHEMBL21557850 | 0.89 | MAPT (0.52) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 | |
| Iodide SCHEMBL3861799 | 0.87 | CYP1A2 (0.50) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 | |
| Water SCHEMBL6414988 | 0.87 | CYP1A2 (0.50) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 | |
| Water SCHEMBL7613695 | 0.87 | CYP1A2 (0.50) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 | |
| SCHEMBL31598893 | 0.87 | CYP1A2 (0.50) | CYP1A2CYP2D6MAPTKMT2ACYP2C19 |
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-20240114907-A1 | STABILIZED CONAZOLE COMPOSITION | UPL CORPORATION LTD (MU) | 2024-04-11 | — | — | US | disclosed |