Ethylenediamine

Ethylenediamine

SCHEMBL8076404

NCC(N)(I)I.NCCN.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Pt+2].[Pt+2]

nearest known ligand 0.30

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 2)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
Ethylenediamine SCHEMBL28858115 0.80 MEN1 (0.46) MEN1KMT2A
Ethylenediamine SCHEMBL4862440 0.80 MEN1 (0.46) MEN1KMT2A
Ethylenediamine SCHEMBL8214216 0.80 MEN1 (0.46) MEN1KMT2A
Ethylenediamine SCHEMBL9645942 0.76 MEN1 (0.50) MEN1KMT2A
Ethylenediamine SCHEMBL29646648 0.74 MEN1 (0.40) MEN1KMT2A
Ethylenediamine SCHEMBL3613718 0.73 MEN1 (0.46) MEN1KMT2A
Ethylenediamine SCHEMBL11236232 0.73
Ethylenediamine SCHEMBL8214212 0.73 MEN1 (0.46) MEN1KMT2A
Ethylenediamine SCHEMBL3746452 0.73 MEN1 (0.46) MEN1KMT2A
Ethylenediamine SCHEMBL6286613 0.73 MEN1 (0.46) MEN1KMT2A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6018022-A A THREE-DIMENSIONAL STRUCTURE OF CRYSTALLINE PERTUSSIS HOLOTOXIN BY COMPLEXING WITH A POLYSACCHARIDE MOLECULE TO FORM A COMPLEX; THERAPY AND DIAGNOSIS CONNAUGHT LABORATORIES LIMITED (CA) 2000-01-25 US disclosed