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 | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 2/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | GLO1 | Q04760 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL121153 | 0.91 | LMNA (0.53) | LMNAHPGDHIF1AHSD17B10RECQL | |
| Hydrochloric Acid SCHEMBL5858440 | 0.89 | LMNA (0.51) | LMNAHPGDHIF1AHSD17B10RECQL | |
| Water SCHEMBL3002925 | 0.89 | LMNA (0.51) | LMNAHPGDHIF1AHSD17B10RECQL | |
| Ammonia Solution, Strong SCHEMBL1924833 | 0.89 | LMNA (0.51) | LMNAHPGDHIF1AHSD17B10RECQL | |
| Ethylene Glycol SCHEMBL6331832 | 0.87 | LMNA (0.51) | LMNAHPGDHIF1AHSD17B10RECQL | |
| Isopropylamine SCHEMBL2350745 | 0.86 | LMNA (0.46) | LMNAHPGDHIF1AHSD17B10RECQL | |
| 1,4-Butanediol SCHEMBL8980142 | 0.84 | LMNA (0.49) | LMNAHPGDHIF1AHSD17B10RECQL | |
| 1,3-Propanediol SCHEMBL8503984 | 0.84 | LMNA (0.49) | LMNAHPGDHIF1AHSD17B10RECQL | |
| Acetic Acid SCHEMBL1232489 | 0.84 | LMNA (0.47) | LMNAHPGDHIF1AHSD17B10RECQL | |
| Di(Hydroxyethyl)Ether SCHEMBL6210102 | 0.83 | LMNA (0.45) | LMNAHPGDHIF1AHSD17B10RECQL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0379483-B1 | 1,2,3,4,10,14b-HEXAHYDRODIBENZO c,f]PYRAZINO- 1,2-a]AZEPINO DERIVATIVES | UNIV MONASH (AU) | 1999-12-29 | — | — | EP | claimed |
| US-4290971-A | HYPOTENSIVE AGENTS | DSO "PHARMACHIM" (BG) | 1981-09-22 | — | — | US | disclosed |