Quercetin

Quercetin

SCHEMBL10335403

O=C1CC(c2ccccc2)Oc2ccccc21.O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.62
KMT2A Q03164 9/20 0.62
CYP3A4 P08684 8/20 0.62
CYP1A2 P05177 8/20 0.62
HSD17B10 Q99714 7/20 0.62
MAPT P10636 7/20 0.62
CYP1A1 P04798 7/20 0.62
CYP1B1 Q16678 7/20 0.62
CYP2C9 P11712 6/20 0.62
KDM4E B2RXH2 6/20 0.62
CYP2D6 P10635 5/20 0.62
CYP2C19 P33261 5/20 0.62
CYP19A1 P11511 5/20 0.62
XDH P47989 5/20 0.62
APP P05067 5/20 0.62
IPMK Q8NFU5 5/20 0.62
IP6K2 Q9UHH9 5/20 0.62
ALOX15 P16050 4/20 0.62
HIF1A Q16665 4/20 0.62
RECQL P46063 4/20 0.62

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
Isorhamnetin SCHEMBL28113738 0.90 CYP1A1 (0.66) MEN1KMT2ACYP3A4CYP1A2HSD17B10
Fisetin SCHEMBL23282487 0.87 CYP3A4 (0.62) MEN1KMT2ACYP3A4CYP1A2HSD17B10
Quercetin SCHEMBL220351 0.84 CYP3A4 (0.63) MEN1KMT2ACYP3A4CYP1A2HSD17B10
Quercetin SCHEMBL4436805 0.84 CYP3A4 (0.62) MEN1KMT2ACYP3A4CYP1A2HSD17B10
Quercetin SCHEMBL28118226 0.83 MEN1 (0.61) MEN1KMT2ACYP3A4CYP1A2HSD17B10
Quercetin SCHEMBL4173190 0.80 MEN1 (0.87) MEN1KMT2ACYP3A4CYP1A2HSD17B10
Quercetin SCHEMBL3958393 0.80 MEN1 (0.87) MEN1KMT2ACYP3A4CYP1A2HSD17B10
Quercetin SCHEMBL31507620 0.79 MEN1 (1.00) MEN1KMT2ACYP3A4CYP1A2HSD17B10
Quercetin SCHEMBL118425 0.79 MEN1 (1.00) MEN1KMT2ACYP3A4CYP1A2HSD17B10
Quercetin SCHEMBL29723041 0.79 MEN1 (1.00) MEN1KMT2ACYP3A4CYP1A2HSD17B10

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
EP-0290442-A4 PHARMACOLOGICALLY ACTIVE COMPOUNDS AND MIXTURES THEREOF, ORGANIC COMPOSITIONS AND METAL SALTS. CHEMEX PHARMACEUTICALS INC (US) 1990-07-03 EP disclosed
EP-0290442-A1 PHARMACOLOGICALLY ACTIVE COMPOUNDS AND MIXTURES THEREOF, ORGANIC COMPOSITIONS AND METAL SALTS CHEMEX PHARMACEUTICALS, INC. (US) 1988-11-17 EP disclosed
WO-1988003805-A1 PHARMACOLOGICALLY ACTIVE COMPOUNDS AND MIXTURES THEREOF, ORGANIC COMPOSITIONS AND METAL SALTS CHEMEX PHARMACEUTICALS, INC. (US) 1988-06-02 WO disclosed