Allylamine

Allylamine

SCHEMBL5391992

C=CC(=O)NCCN(C)C.C=CCN

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
MAPK1 P28482 2/20 0.47
TSHR P16473 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
DNM1 Q05193 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HTT P42858 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TGM2 P21980 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL27346 0.91 ALDH1A1 (0.56) ALDH1A1MAPK1TSHRTDP1ZDHHC20
Hydrochloric Acid SCHEMBL2804444 0.89 ALDH1A1 (0.54) ALDH1A1MAPK1TSHRTDP1ZDHHC20
Bicarbonate SCHEMBL9017531 0.87 ALDH1A1 (0.52) ALDH1A1MAPK1TSHRTDP1ZDHHC20
Chloromethane SCHEMBL1099332 0.87 ALDH1A1 (0.52) ALDH1A1MAPK1TSHRTDP1ZDHHC20
SCHEMBL27782054 0.84 ALDH1A1 (0.48) ALDH1A1MAPK1TSHRTDP1ZDHHC20
SCHEMBL27642913 0.83 ALDH1A1 (0.44) ALDH1A1MAPK1TSHRTDP1ZDHHC20
Methacrylic Acid SCHEMBL28850506 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1TSHRTDP1ZDHHC20
SCHEMBL8012770 0.81 ZDHHC20 (0.47) ALDH1A1MAPK1TSHRTDP1ZDHHC20
SCHEMBL21611 0.79 ZDHHC20 (0.58) ALDH1A1MAPK1TSHRTDP1ZDHHC20
SCHEMBL27790589 0.79 ZDHHC20 (0.58) ALDH1A1MAPK1TSHRTDP1ZDHHC20

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7247370-B2 Asymmetric gel-filled microporous membranes MCMASTER UNIVERSITY (CA) 2007-07-24 US disclosed
EP-1409119-B1 ASYMMETRIC GEL-FILLED MICROPOROUS MEMBRANES UNIV MCMASTER (CA) 2006-06-21 EP disclosed
US-20050011826-A1 Asymmetric gel-filled microporous membranes MCMASTER UNIVERSITY (CA) 2005-01-20 US disclosed
EP-1409119-A2 ASYMMETRIC GEL-FILLED MICROPOROUS MEMBRANES McMaster University (CA) 2004-04-21 EP disclosed
WO-2003008078-A2 ASYMMETRIC GEL-FILLED MICROPOROUS MEMBRANES MCMASTER UNIVERSITY (CA) 2003-01-30 WO disclosed