Allylamine

Allylamine

SCHEMBL8079797

C=CCN.C=Cc1ccccn1

nearest known ligand 0.58

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
KMT2A Q03164 2/20 0.58
ATM Q13315 1/20 0.58
GRM4 Q14833 1/20 0.46
NR4A1 P22736 1/20 0.41
MAOA P21397 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HRH1 P35367 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
G6PC1 P35575 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
USP2 O75604 1/20 0.37
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37
PI4KA P42356 1/20 0.37

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
Allylamine SCHEMBL27777717 0.98 MEN1 (0.56) MEN1NPC1RAB9AKMT2AATM
Hydrazine SCHEMBL27532097 0.87 MEN1 (0.61) MEN1NPC1RAB9AKMT2AATM
SCHEMBL9359592 0.87 MEN1 (0.67) MEN1NPC1RAB9AKMT2AATM
SCHEMBL29371456 0.87
SCHEMBL15193 0.87
Ethylamine SCHEMBL27777692 0.86 MEN1 (0.50) MEN1NPC1RAB9AKMT2AATM
Ethylamine SCHEMBL28732707 0.86 MEN1 (0.50) MEN1NPC1RAB9AKMT2AATM
Methylamine SCHEMBL3957983 0.85 MEN1 (0.58) MEN1NPC1RAB9AKMT2AATM
Iodide SCHEMBL10987579 0.85 MEN1 (0.64) MEN1NPC1RAB9AKMT2AATM
Iodide SCHEMBL1274592 0.85

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
CN-101362825-B Method for preparing pattern aggregates with fractal characteristics containing carboxymethyl cellulose complex compound UNIV ZHEJIANG 2011-01-19 CN disclosed
CN-101362825-A Method for preparing pattern aggregates with fractal characteristics containing carboxymethyl cellulose complex compound UNIV ZHEJIANG (CN) 2009-02-11 CN disclosed
EP-0710738-B1 FIBER PRODUCT PROCESSING METHOD DAIKIN IND LTD (JP) 2000-09-27 EP disclosed
EP-0710738-A1 FIBER PRODUCT PROCESSING METHOD DAIKIN INDUSTRIES, LIMITED (JP) 1996-05-08 EP disclosed