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 SCHEMBL11504925 | 0.93 | — | — | |
| Ethylenediamine SCHEMBL10902552 | 0.93 | — | — | |
| Ethylenediamine SCHEMBL506541 | 0.93 | — | — | |
| Ethylenediamine SCHEMBL1007637 | 0.93 | — | — | |
| Ethylenediamine SCHEMBL506140 | 0.93 | — | — | |
| Ethylenediamine SCHEMBL4284635 | 0.93 | NFKB1 (0.44) | — | |
| Ethylenediamine SCHEMBL3412753 | 0.93 | NFKB1 (0.44) | — | |
| Ethylenediamine SCHEMBL22027728 | 0.86 | — | — | |
| Ethylenediamine SCHEMBL3898035 | 0.86 | — | — | |
| Ethylenediamine SCHEMBL7085968 | 0.84 | NFKB1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3999593-A1 | MOLECULARLY WELL-DEFINED ANTIBIOFOULING AND POLYIONIC COATINGS | Acatechol, Inc. (US) | 2022-05-25 | — | — | EP | disclosed |