Adenine

Adenine

SCHEMBL28547223

Cn1ccc(N)nc1=O.Nc1ncnc2nc[nH]c12

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 2/20 0.56
PI4K2B Q8TCG2 2/20 0.56
PI4K2A Q9BTU6 2/20 0.56
PI4KB Q9UBF8 2/20 0.56
LRRK2 Q5S007 2/20 0.56
LMNA P02545 2/20 0.56
DRD3 P35462 1/20 0.56
XDH P47989 1/20 0.56
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
PDPK1 O15530 3/20 0.38
GDA Q9Y2T3 1/20 0.38
HTT P42858 1/20 0.37
HRH4 Q9H3N8 1/20 0.37
TP53 P04637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
CHEK1 O14757 1/20 0.36

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
Adenine SCHEMBL2167068 0.76 PI4KA (0.63) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL18189917 0.76 PI4KA (0.63) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL1065186 0.76 PI4KA (0.63) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL1023306 0.76 PI4KA (0.63) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL7002960 0.76 PI4KA (0.63) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL3414606 0.75 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL19929 0.75
Adenine SCHEMBL29442902 0.75 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL1331751 0.75 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL8111 0.75 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBLRRK2

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
CN-112618699-A Reagent capable of providing interleukin 10 with effective treatment amount and antitumor application thereof 深圳先进技术研究院 2021-04-09 CN disclosed