Quercetin

Quercetin

SCHEMBL22076795

CCCCCCCCC(CCCCCC)C(=O)O.O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.67
▸ KMT2A Q03164 9/20 0.67
▸ POLH Q9Y253 7/20 0.67
▸ CYP1A2 P05177 7/20 0.67
▸ CYP3A4 P08684 6/20 0.67
▸ KDM4E B2RXH2 6/20 0.67
▸ HSD17B10 Q99714 6/20 0.67
▸ CYP1A1 P04798 6/20 0.67
▸ CYP1B1 Q16678 6/20 0.67
▸ MAPT P10636 6/20 0.67
▸ RECQL P46063 5/20 0.67
▸ CYP2C9 P11712 5/20 0.67
▸ IPMK Q8NFU5 5/20 0.67
▸ IP6K2 Q9UHH9 5/20 0.67
▸ XDH P47989 5/20 0.67
▸ ALOX15 P16050 4/20 0.67
▸ HIF1A Q16665 4/20 0.67
▸ ABCB1 P08183 4/20 0.67
▸ POLB P06746 4/20 0.67
▸ APP P05067 4/20 0.67

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
Quercetin SCHEMBL28192839 0.88 MEN1 (0.69) MEN1KMT2APOLHCYP1A2CYP3A4
Quercetin SCHEMBL7182490 0.88 MEN1 (0.69) MEN1KMT2APOLHCYP1A2CYP3A4
Quercetin SCHEMBL925101 0.88 MEN1 (0.69) MEN1KMT2APOLHCYP1A2CYP3A4
Quercetin SCHEMBL28192239 0.88 MEN1 (0.69) MEN1KMT2APOLHCYP1A2CYP3A4
Quercetin SCHEMBL7180221 0.84 MEN1 (0.81) MEN1KMT2APOLHCYP1A2CYP3A4
Quercetin SCHEMBL14342895 0.83 MEN1 (0.87) MEN1KMT2APOLHCYP1A2CYP3A4
Quercetin SCHEMBL5126185 0.83 MEN1 (0.87) MEN1KMT2APOLHCYP1A2CYP3A4
Quercetin SCHEMBL7186872 0.83 MEN1 (0.87) MEN1KMT2APOLHCYP1A2CYP3A4
Quercetin SCHEMBL28297224 0.82 MEN1 (0.77) MEN1KMT2APOLHCYP1A2CYP3A4
Nonacosane SCHEMBL28207166 0.82 ABCB1 (0.83) MEN1KMT2APOLHCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200190425-A1 LUBRICATING OIL COMPOSITIONS HAVING FUNCTIONALIZED QUERCETIN ANTIOXIDANTS EXXONMOBIL RES & ENG CO (US) 2020-06-18 — — US claimed
US-20200190425-A1 LUBRICATING OIL COMPOSITIONS HAVING FUNCTIONALIZED QUERCETIN ANTIOXIDANTS EXXONMOBIL RES & ENG CO (US) 2020-06-18 — — US disclosed
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