Quinoxaline

Quinoxaline

SCHEMBL14717879

O=S(=O)(O)CO.c1ccc2nccnc2c1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 3/20 0.37
LMNA P02545 2/20 0.37
HPGD P15428 2/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.36
POLB P06746 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTR1A P08908 2/20 0.35
ADRA1D P25100 2/20 0.35
ADRA1A P35348 2/20 0.35
ADRA1B P35368 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
NPC1 O15118 1/20 0.35

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
Quinoxaline SCHEMBL4270011 0.88 ALDH1A1 (0.44) ALDH1A1L3MBTL1MAPTLMNAHPGD
Quinoline SCHEMBL14717992 0.84 ALDH1A1 (0.65) ALDH1A1L3MBTL1MAPTLMNAHTT
Quinoxaline SCHEMBL10435186 0.78 POLB (0.38) ALDH1A1L3MBTL1MAPTLMNAHTT
Quinoxaline SCHEMBL28065589 0.78 ALDH1A1 (0.37) ALDH1A1L3MBTL1MAPTHPGDSMN1; SMN2
Quinoxaline SCHEMBL11768406 0.78 SMN1; SMN2 (0.67) ALDH1A1L3MBTL1MAPTLMNAHTT
Quinoxaline SCHEMBL16054065 0.78 POLB (0.38) ALDH1A1L3MBTL1MAPTLMNAHTT
Quinoxaline SCHEMBL19877227 0.78 ALDH1A1 (0.44) ALDH1A1MAPTHPGDLOXL2POLB
Quinoxaline SCHEMBL27732327 0.78 ALDH1A1 (0.44) ALDH1A1MAPTLMNAHPGDHTT
Quinoxaline SCHEMBL27549902 0.77 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPTLMNAHPGD
Quinoxaline SCHEMBL29355228 0.77 ALDH1A1 (0.58) ALDH1A1MAPTLMNAHPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103763947-B Method and composition for protecting beverages from heat and light stress 百事可乐公司 2018-02-13 CN disclosed
CN-103763947-A Method and composition for protecting beverages from heat and light stress PEPSICO INC 2014-04-30 CN disclosed
US-20130052315-A1 Methods and Compositions for Protecting Beverages From Heat and Light Stress PEPSICO, INC. (US) 2013-02-28 US disclosed