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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 3/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.34 |
| ▸ | STAT6 | P42226 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | HBB | P68871 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11626057 | 0.90 | F2 (0.40) | F2PRSS1PRSS2PRSS3CYP1A2 | |
| SCHEMBL11625502 | 0.88 | LMNA (0.44) | F2PRSS1PRSS2PRSS3CYP1A2 | |
| Ethylenediamine SCHEMBL11623103 | 0.87 | F2 (0.36) | F2PRSS1PRSS2PRSS3PLAU | |
| Ethylenediamine SCHEMBL11623099 | 0.87 | F2 (0.36) | F2PRSS1PRSS2PRSS3PLAU | |
| SCHEMBL35828 | 0.86 | CYP1A2 (0.45) | F2PRSS1PRSS2PRSS3CYP1A2 | |
| SCHEMBL29514787 | 0.86 | CYP1A2 (0.45) | F2PRSS1PRSS2PRSS3CYP1A2 | |
| Ethylenediamine SCHEMBL11297757 | 0.85 | F2 (0.35) | F2PRSS1PRSS2PRSS3ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL11581673 | 0.83 | F2 (0.43) | F2PRSS1PRSS2PRSS3CYP1A2 | |
| Hydrochloric Acid SCHEMBL10627844 | 0.83 | F2 (0.43) | F2PRSS1PRSS2PRSS3CYP1A2 | |
| SCHEMBL5704041 | 0.83 | F2 (0.43) | F2PRSS1PRSS2PRSS3CYP1A2 |
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-4092345-A | (Cyclo)alkylenediammonium-bis-tetrahalophthalates | CITIES SERVICE COMPANY (US) | 1978-05-30 | — | — | US | disclosed |