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 SCHEMBL1886239 | 0.86 | — | — | |
| Ethylenediamine SCHEMBL6698389 | 0.86 | NFKB1 (0.40) | — | |
| Ethylenediamine SCHEMBL1524112 | 0.86 | NFKB1 (0.40) | — | |
| Ethylenediamine SCHEMBL17223138 | 0.86 | NFKB1 (0.40) | — | |
| Ethylenediamine SCHEMBL28924405 | 0.84 | NFKB1 (0.50) | — | |
| Ethylenediamine SCHEMBL7085968 | 0.84 | NFKB1 (0.50) | — | |
| Ethylenediamine SCHEMBL30253568 | 0.84 | — | — | |
| Ethylenediamine SCHEMBL37647 | 0.84 | — | — | |
| Ethylenediamine SCHEMBL3083 | 0.84 | — | — | |
| Ethylenediamine SCHEMBL5505356 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5142075-A | Anti-tumor platinum(II) complexes and process for the preparation thereof | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 1992-08-25 | — | — | US | disclosed |
| US-4614811-A | REACTING BARIUM SALT OF AMINOMALONIC ACID WITH PLATINUM SULFATE AMINO INTERMEDIATE | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) | 1986-09-30 | — | — | US | disclosed |