Ethylenediamine

Ethylenediamine

SCHEMBL7570860

CC(=O)N(C#N)C#N.NCCN

nearest known ligand 0.32

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 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PAOX Q6QHF9 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL2461368 0.87
SCHEMBL7568722 0.82 CYP2D6 (0.42)
SCHEMBL8414401 0.75 DPP4 (0.39)
Piperazine SCHEMBL8415293 0.73
SCHEMBL1417525 0.72
Acetic Acid SCHEMBL27584962 0.70 FFAR3 (0.41) MEN1KMT2APAOX
SCHEMBL1417711 0.70
Ethylenediamine SCHEMBL28215986 0.69 PAOX (0.38) PAOX
Acetic Acid SCHEMBL19893759 0.69 KMT2A (0.39) MEN1KMT2APAOX
Acetic Acid SCHEMBL11858011 0.68 FFAR3 (0.54) MEN1KMT2APAOX

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-0934256-B1 PROCESS FOR THE PRODUCTION OF CYANOCINNAMAMIDES HONEYWELL INT INC (US) 2002-08-21 EP disclosed
EP-0934256-A1 PROCESS FOR THE PRODUCTION OF CYANOCINNAMAMIDES AlliedSignal Inc. (US) 1999-08-11 EP disclosed
WO-1998016501-A1 PROCESS FOR THE PRODUCTION OF CYANOCINNAMAMIDES ALLIEDSIGNAL INC. (US) 1998-04-23 WO disclosed
US-5654465-A Process for the production of cyanocinnamamides ALLIEDSIGNAL INC. (US) 1997-08-05 US disclosed