Ethylenediamine

Ethylenediamine

SCHEMBL11054948

NCCN.O=S(=O)(O)Oc1ccccc1

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 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.54
CA2 P00918 5/20 0.54
CA9 Q16790 5/20 0.54
TAAR1 Q96RJ0 1/20 0.48
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
LTA4H P09960 1/20 0.42
PLA2G2A P14555 1/20 0.42
STS P08842 2/20 0.42
LMNA P02545 1/20 0.40
PPARG P37231 1/20 0.40
NFE2L2 Q16236 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CA12 O43570 2/20 0.39
PARP10 Q53GL7 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RECQL P46063 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39

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
Hydrazine SCHEMBL5800947 0.89 CA2 (0.60) CA1CA2CA9KMT2AMEN1
SCHEMBL138895 0.89 CA2 (0.58) CA1CA2CA9KMT2AMEN1
Glycine SCHEMBL11051905 0.88 CA1 (0.50) CA1CA2CA9KMT2AMEN1
Methylamine SCHEMBL7562548 0.87 CA2 (0.58) CA1CA2CA9KMT2AMEN1
SCHEMBL17456525 0.87 CA1 (0.56) CA1CA2CA9KMT2AMEN1
SCHEMBL17456405 0.87 CA1 (0.56) CA1CA2CA9KMT2AMEN1
Iodide SCHEMBL1361736 0.87 CA1 (0.56) CA1CA2CA9KMT2AMEN1
Water SCHEMBL2134977 0.87 CA1 (0.56) CA1CA2CA9KMT2AMEN1
Ammonia Solution, Strong SCHEMBL1115426 0.87 CA1 (0.56) CA1CA2CA9KMT2AMEN1
SCHEMBL8058040 0.87 CA1 (0.56) CA1CA2CA9KMT2AMEN1

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-4427762-A DEVELOPMENT WITH ALKALINE DEVELOPER MIXTURE KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1984-01-24 US disclosed