Benzylamine

Benzylamine

SCHEMBL6004866

COc1cc2nccc(Oc3cc4cccnc4nc3-c3ccccc3)c2cc1C(=O)O.NCc1ccccc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.46
MET P08581 9/20 0.46
AURKA O14965 6/20 0.46
TEK Q02763 6/20 0.46
AURKB Q96GD4 6/20 0.46
SRC P12931 3/20 0.44
TGFBR1 P36897 3/20 0.44
LCK P06239 3/20 0.43
ABL1 P00519 1/20 0.43
LYN P07948 1/20 0.43
AXL P30530 3/20 0.41
MERTK Q12866 2/20 0.41
CYP3A4 P08684 1/20 0.40
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40

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
SCHEMBL6004924 0.88 KDR (0.57) KDRMETAURKATEKAURKB
SCHEMBL6002935 0.86 SRC (0.48) KDRMETAURKATEKAURKB
Beclamide SCHEMBL6004863 0.85 MET (0.43) KDRMETAURKATEKAURKB
SCHEMBL6005288 0.84 KDR (0.52) KDRMETAURKATEKAURKB
SCHEMBL3895779 0.83 FGFR2 (0.53) KDRSRCTGFBR1AXLPDGFRB
SCHEMBL6004737 0.83 SRC (0.48) KDRMETAURKATEKAURKB
SCHEMBL6004096 0.82 PDPK1 (0.47) KDRMETSRCTGFBR1PDGFRB
SCHEMBL6004257 0.82 PDPK1 (0.47) KDRMETSRCTGFBR1PDGFRB
SCHEMBL6005276 0.81 SRC (0.44) KDRSRCTGFBR1AXLPDGFRB
SCHEMBL6004812 0.81 FGFR2 (0.44) KDRMETSRCTGFBR1AXL

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-1724268-A1 COMPOUND HAVING TGF-BETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-22 EP disclosed