SCHEMBL483671

SCHEMBL483671

Nc1nc2ccccc2c2c1ncn2-c1cccnc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 2/20 0.51
PI4K2B Q8TCG2 2/20 0.51
PI4K2A Q9BTU6 2/20 0.51
PI4KB Q9UBF8 2/20 0.51
TLR7 Q9NYK1 8/20 0.50
ADORA2A P29274 2/20 0.50
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
HRH2 P25021 1/20 0.50
ADRA1D P25100 1/20 0.50
HTR2A P28223 1/20 0.50
ADRA1A P35348 1/20 0.50
NUDT1 P36639 1/20 0.50
HTR2B P41595 1/20 0.50
PDE4D Q08499 1/20 0.50
KCNH2 Q12809 1/20 0.50
ADORA3 P0DMS8 1/20 0.44
ADORA1 P30542 1/20 0.44
ALOX12 P18054 1/20 0.43
CLK1 P49759 1/20 0.41

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
SCHEMBL3864342 0.89 TLR7 (0.57) PI4KAPI4K2BPI4K2API4KBTLR7
SCHEMBL10744495 0.80 ADORA2A (0.51) PI4KAPI4K2BPI4K2API4KBTLR7
SCHEMBL10743830 0.77 ADORA2A (0.58) PI4KAPI4K2BPI4K2API4KBTLR7
SCHEMBL3863667 0.76 PDPK1 (0.47) PI4KAPI4K2BPI4K2API4KBALOX12
SCHEMBL4753594 0.74 TLR7 (0.59) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL20741451 0.74 TLR7 (0.50) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL3183969 0.73 TLR7 (0.62) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL6030934 0.73 TLR7 (0.59) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL20741465 0.73 TLR7 (0.49) PI4KAPI4K2BPI4K2API4KBTLR7
SCHEMBL6698894 0.72 TLR7 (0.51) TLR7ADORA2ALMNAPOLBHRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411521-A1 COMPOSITIONS FOR STIMULATION OF MAMMALIAN INNATE IMMUNE RESISTANCE TO PATHOGENS The Board of Regents of The University of Texas System (US) 2012-02-01 EP disclosed
WO-2010111485-A1 COMPOSITIONS FOR STIMULATION OF MAMMALIAN INNATE IMMUNE RESISTANCE TO PATHOGENS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-09-30 WO disclosed