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 | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | GABRR3 | A8MPY1 | 1/20 | 0.31 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
| ▸ | GABRD | O14764 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
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 SCHEMBL11623099 | 0.87 | F2 (0.36) | HTTPLAU | |
| Ethylenediamine SCHEMBL11623103 | 0.87 | F2 (0.36) | HTTPLAU | |
| SCHEMBL27772 | 0.86 | HTT (0.50) | HTTCES2CES1DPP4CYP3A4 | |
| SCHEMBL29431520 | 0.86 | HTT (0.50) | HTTCES2CES1DPP4CYP3A4 | |
| Monoethanolamine SCHEMBL1833201 | 0.85 | ALDH1A1 (0.38) | HTTPLAUCES2CES1DPP4 | |
| Fluoride SCHEMBL6441994 | 0.83 | HTT (0.54) | HTTCES2CES1DPP4CYP3A4 | |
| SCHEMBL11158141 | 0.83 | HTT (0.48) | HTTCES2CES1DPP4CYP3A4 | |
| SCHEMBL3630379 | 0.83 | HTT (0.48) | HTTCES2CES1DPP4CYP3A4 | |
| Hydrochloric Acid SCHEMBL10668016 | 0.83 | HTT (0.48) | HTTCES2CES1DPP4CYP3A4 | |
| SCHEMBL6903601 | 0.83 | HTT (0.48) | HTTCES2CES1DPP4CYP3A4 |
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 |