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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 1/20 | 0.73 |
| ▸ | GSK3B | P49841 | 1/20 | 0.73 |
| ▸ | CCR6 | P51684 | 1/20 | 0.73 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL17104496 | 0.91 | GSK3A (0.61) | GSK3AGSK3BCCR6 | |
| SCHEMBL27712721 | 0.89 | GSK3A (0.58) | GSK3AGSK3BCCR6 | |
| Ethylamine SCHEMBL28676595 | 0.88 | GSK3A (0.65) | GSK3AGSK3BCCR6 | |
| Hydrazine SCHEMBL3175189 | 0.86 | — | — | |
| SCHEMBL28058947 | 0.86 | — | — | |
| SCHEMBL33524954 | 0.86 | — | — | |
| SCHEMBL1599522 | 0.86 | — | — | |
| SCHEMBL10990 | 0.86 | — | — | |
| SCHEMBL7021498 | 0.86 | — | — | |
| SCHEMBL693917 | 0.86 | GSK3B (1.00) | GSK3AGSK3BCCR6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104448296-B | alkynyl multi-arm polyethylene glycol derivative | 北京键凯科技股份有限公司 | 2018-01-05 | — | — | CN | claimed |
| EP-0413305-B1 | Chlorosulfonated polyethylene polymer composition | TOSOH CORP (JP) | 1998-04-08 | — | — | EP | disclosed |
| US-5344861-A | Polymer blend with organic acid, phenylamine, phenylenediamine and acid acceptor with vulcanization agent | TOSOH CORPORATION (JP) | 1994-09-06 | — | — | US | disclosed |