Purine

Purine

SCHEMBL28177652

CC(O)C(=O)O.c1ncc2[nH]cnc2n1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRM1DRD2DRD3DRD4HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR2APDE3ASIGMAR1

The experimentally established mechanism targets of Purine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
NTRK1 P04629 1/20 0.36
TP53 P04637 3/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CPB2 Q96IY4 3/20 0.34
RXFP1 Q9HBX9 1/20 0.34
CPB1 P15086 1/20 0.34
CYP1A2 P05177 1/20 0.34
MME P08473 1/20 0.33
TSHR P16473 2/20 0.33
GAA P10253 1/20 0.32
BRD4 O60885 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CDK2 P24941 1/20 0.31
TOP2A P11388 1/20 0.31
BRAF P15056 1/20 0.31

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
Purine SCHEMBL8066127 0.89 SMN1; SMN2 (0.37) SMN1; SMN2NTRK1TP53KDM4EALDH1A1
Purine SCHEMBL21998271 0.89 SMN1; SMN2 (0.37) SMN1; SMN2NTRK1TP53KDM4EALDH1A1
Purine SCHEMBL28153340 0.89 KDM4E (0.39) SMN1; SMN2NTRK1TP53KDM4EALDH1A1
Purine SCHEMBL28724547 0.85 SMN1; SMN2 (0.38) SMN1; SMN2NTRK1TP53KDM4EALDH1A1
Purine SCHEMBL5788025 0.85 SLC7A5 (0.42) SMN1; SMN2NTRK1TP53KDM4EALDH1A1
Purine SCHEMBL29465224 0.85 ALDH1A1 (0.39) SMN1; SMN2NTRK1KDM4EALDH1A1RXFP1
Purine SCHEMBL28164598 0.85 ALDH1A1 (0.44) TP53KDM4EALDH1A1RXFP1CYP1A2
Purine SCHEMBL28299820 0.83 SMN1; SMN2 (0.39) SMN1; SMN2NTRK1TP53KDM4EALDH1A1
Purine SCHEMBL27575443 0.83 ALDH1A1 (0.42) TP53KDM4EALDH1A1RXFP1CYP1A2
Purine SCHEMBL9934578 0.82 ALDH1A1 (0.41) SMN1; SMN2NTRK1TP53KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4585923-A1 METHOD AND KIT FOR DIAGNOSING MIDD East China University of Science and Technology (CN) 2025-07-16 EP disclosed
CN-110684685-B Lactobacillus fermentum 9-4 and application thereof 广西大学 2021-03-30 CN disclosed
CN-110684685-A Lactobacillus fermentum 9-4 and application thereof 广西大学 2020-01-14 CN disclosed
CN-107208029-A Lactic acid bacteria of ability and application thereof is absorbed with purine 株式会社明治 2017-09-26 CN disclosed