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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL9645942 | 0.96 | MEN1 (0.50) | — | |
| Ethylenediamine SCHEMBL8214212 | 0.92 | MEN1 (0.46) | — | |
| Ethylenediamine SCHEMBL3746452 | 0.92 | MEN1 (0.46) | — | |
| Ethylenediamine SCHEMBL2023673 | 0.92 | MEN1 (0.46) | — | |
| Ethylenediamine SCHEMBL11443647 | 0.92 | MEN1 (0.46) | — | |
| Ethylenediamine SCHEMBL8580116 | 0.92 | — | — | |
| Ethylenediamine SCHEMBL3613718 | 0.92 | MEN1 (0.46) | — | |
| Ethylenediamine SCHEMBL3746450 | 0.92 | MEN1 (0.46) | — | |
| Ethylenediamine SCHEMBL6286613 | 0.92 | MEN1 (0.46) | — | |
| Ethylenediamine SCHEMBL11039278 | 0.92 | MEN1 (0.46) | — |
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-4364918-A | REACTION WITH NICKEL DERIVATIVE OF ETHYLENEDIAMINE | MOBIL OIL CORPORATION (US) | 1982-12-21 | — | — | US | disclosed |