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 SCHEMBL28116606 | 0.95 | — | — | |
| Monoethanolamine SCHEMBL28166071 | 0.77 | — | — | |
| SCHEMBL2163371 | 0.76 | — | — | |
| Ethylenediamine SCHEMBL30253568 | 0.74 | — | — | |
| Ethylenediamine SCHEMBL37647 | 0.74 | — | — | |
| Ethylenediamine SCHEMBL7085968 | 0.74 | NFKB1 (0.50) | — | |
| Ethylenediamine SCHEMBL3083 | 0.74 | — | — | |
| Ethylenediamine SCHEMBL28924405 | 0.74 | NFKB1 (0.50) | — | |
| Ethylenediamine SCHEMBL23633140 | 0.68 | — | — | |
| Ethylenediamine SCHEMBL11504925 | 0.68 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109354419-A | A kind of preparation method of high-efficiency heat conduction surface modified graphite alkene film | 南京新月材料科技有限公司 | 2019-02-19 | — | — | CN | claimed |
| CN-105923627-B | A kind of preparation method of porous graphene | 南京邮电大学 | 2018-11-30 | — | — | CN | claimed |
| CN-106241776-A | A kind of preparation method of the graphene composite thin film of LBL self-assembly | 南京邮电大学 | 2016-12-21 | — | — | CN | claimed |
| CN-105923627-A | Preparation method of porous graphene | 南京邮电大学 | 2016-09-07 | — | — | CN | claimed |
| CN-105923627-B | A kind of preparation method of porous graphene | 南京邮电大学 | 2018-11-30 | — | — | CN | disclosed |
| CN-105923627-A | Preparation method of porous graphene | 南京邮电大学 | 2016-09-07 | — | — | CN | disclosed |
| CN-105502350-A | Graphene oxide and ionic liquid composite film and preparation method thereof | NANJING XINYUE MAT SCIENCE & TECH CO LTD | 2016-04-20 | — | — | CN | disclosed |
| CN-105256408-A | Graphene oxide fibers and preparation method thereof | NANJING XINYUE MATERIAL SCIENCE & TECHNOLOGY CO LTD | 2016-01-20 | — | — | CN | disclosed |