Purine

Purine

SCHEMBL28215545

NC1(Cc2ccccc2)N=CN=C2N=CN=C21.c1ncc2[nH]cnc2n1

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 2/20 0.32
DBF4 Q9UBU7 2/20 0.32
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
PRKACA P17612 1/20 0.30
PRKACG P22612 1/20 0.30
PRKACB P22694 1/20 0.30
AKT2 P31751 1/20 0.30

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
SCHEMBL94056 0.80 MAOA (0.37)
SCHEMBL27690678 0.80 MAOA (0.37)
SCHEMBL27482347 0.79 MAOA (0.36)
SCHEMBL27465145 0.79 MAOA (0.36)
6-Benzylaminopurine SCHEMBL725575 0.78 LMNA (0.60) CDC7DBF4NPC1LMNAHTT
Guanine SCHEMBL28321130 0.75 PNP (0.48) LMNA
Phosphoric Acid SCHEMBL27761451 0.73 LAP3 (0.32) HTT
Purine SCHEMBL9215924 0.71 LOXL2 (0.42) CDC7DBF4NPC1LMNAHTT
Purine SCHEMBL14603411 0.70 CDC7 (0.50) CDC7DBF4NPC1LMNAHTT
Phenylacetaldehyde SCHEMBL27957476 0.67 CDC7 (0.42) CDC7DBF4NPC1LMNAHTT

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-104996302-B A kind of method for improving Iris pseudacorus callus inductivity 浙江大学 2018-05-18 CN disclosed