Methylamine

Methylamine

SCHEMBL11569839

CN.O=[N+]([O-])Nc1c(Br)cc(Br)cc1Br

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32
HSP90AA1 P07900 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL10798876 0.94 MEN1 (0.34) CYP3A4ALDH1A1MEN1HSP90AA1KMT2A
SCHEMBL11380871 0.92 MEN1 (0.33) CYP3A4ALDH1A1MEN1HSP90AA1KMT2A
SCHEMBL11375965 0.92 MEN1 (0.33) CYP3A4ALDH1A1MEN1HSP90AA1KMT2A
Ammonia Solution, Strong SCHEMBL11568377 0.92 MEN1 (0.33) CYP3A4ALDH1A1MEN1HSP90AA1KMT2A
Ethylamine SCHEMBL11570002 0.91 POLB (0.31) CYP3A4ALDH1A1
SCHEMBL11569362 0.85
SCHEMBL10800640 0.81 MEN1 (0.31) MEN1HSP90AA1KMT2A
SCHEMBL10796213 0.81 NMT1 (0.37) ALDH1A1MEN1HSP90AA1KMT2ATSHR
SCHEMBL10796701 0.80 GABRA1 (0.40)
SCHEMBL10799251 0.80 AKR1C2 (0.49) CYP3A4ALDH1A1MEN1KMT2ATDP1

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
EP-0003880-A1 Substituted phenylnitramines with plant growth regulating properties AMERICAN CYANAMID COMPANY (US) 1979-09-05 EP disclosed