Ethylenediamine

Ethylenediamine

SCHEMBL20954155

NCCN.O=C(O)CC(NC(CC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

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 11)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 3/20 0.42
▸ CA4 P22748 1/20 0.42
▸ GABRR1 P24046 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ CTH P32929 1/20 0.39
▸ FOLH1 Q04609 1/20 0.39
▸ TGFBR1 P36897 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ GNPAT O15228 1/20 0.38
▸ CA1 P00915 1/20 0.38

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.

Compoundsimilaritytop predictedshared targets
Glycine SCHEMBL28463137 0.91 GLRA1 (0.48) CA2CA4GABRR1LMNATDP1
Hydroxyamine SCHEMBL631500 0.90 CA2 (0.45) CA2CA4GABRR1LMNATDP1
SCHEMBL1457564 0.90 CA2 (0.48) CA2CA4TDP1FOLH1TGFBR1
SCHEMBL22019 0.90 CA2 (0.48) CA2CA4TDP1FOLH1TGFBR1
SCHEMBL2916092 0.90 CA2 (0.48) CA2CA4TDP1FOLH1TGFBR1
SCHEMBL2910640 0.90 CA2 (0.48) CA2CA4TDP1FOLH1TGFBR1
SCHEMBL18419474 0.87 CA2 (0.47) CA2CA4TDP1FOLH1TGFBR1
SCHEMBL1419353 0.87 CA2 (0.47) CA2CA4TDP1FOLH1TGFBR1
SCHEMBL5327417 0.87 CA2 (0.47) CA2CA4TDP1FOLH1TGFBR1
SCHEMBL3055923 0.87 CA2 (0.47) CA2CA4TDP1FOLH1TGFBR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3480287-B1 SOLID WATER-SOLUBLE CLEANING COMPOSITION DALLI WERKE GMBH & CO KG (DE) 2020-03-18 — — EP claimed
EP-3480287-A1 SOLID WATER-SOLUBLE CLEANING COMPOSITION Dalli-Werke GmbH & Co. KG (DE) 2019-05-08 — — EP claimed
EP-3480287-B1 SOLID WATER-SOLUBLE CLEANING COMPOSITION DALLI WERKE GMBH & CO KG (DE) 2020-03-18 — — EP disclosed
EP-3480287-A1 SOLID WATER-SOLUBLE CLEANING COMPOSITION Dalli-Werke GmbH & Co. KG (DE) 2019-05-08 — — EP disclosed
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