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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | ANPEP | P15144 | 1/20 | 0.30 |
| ▸ | ERAP2 | Q6P179 | 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 | |
|---|---|---|---|---|
| Ethylenediamine SCHEMBL2112258 | 1.00 | — | — | |
| SCHEMBL21312 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL7565912 | 0.84 | — | — | |
| SCHEMBL6131144 | 0.84 | — | — | |
| SCHEMBL14889442 | 0.84 | ALDH1A1 (0.46) | ALDH1A1ANPEPERAP2 | |
| Hydrochloric Acid SCHEMBL3264358 | 0.80 | — | — | |
| Ethylenediamine SCHEMBL2160623 | 0.73 | ALDH1A1 (0.38) | ALDH1A1ANPEPERAP2 | |
| Hydrochloric Acid SCHEMBL7675748 | 0.73 | — | — | |
| Ethylenediamine SCHEMBL4626626 | 0.73 | — | — | |
| Ethylenediamine SCHEMBL3083 | 0.71 | — | — |
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-4089803-A | Demulsification of surfactant-petroleum-water flood emulsions | PETROLITE CORPORATION (US) | 1978-05-16 | — | — | US | disclosed |