(+)-Taxifolin

(+)-Taxifolin

SCHEMBL29444269

CC(=O)O.O=C(O)CO[C@H]1C(=O)c2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1.O=C1c2c(O)cc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 0.68
▸ ALOX15 P16050 4/20 0.68
▸ MAPT P10636 3/20 0.68
▸ HSD17B10 Q99714 3/20 0.68
▸ RECQL P46063 2/20 0.68
▸ SOST Q9BQB4 2/20 0.68
▸ MEN1 O00255 2/20 0.68
▸ KMT2A Q03164 2/20 0.68
▸ KDM4E B2RXH2 2/20 0.68
▸ GAA P10253 2/20 0.68
▸ ALOX12 P18054 2/20 0.68
▸ HIF1A Q16665 2/20 0.68
▸ POLB P06746 1/20 0.68
▸ CYP1A2 P05177 1/20 0.68
▸ NFKB1 P19838 1/20 0.68
▸ MAPK1 P28482 1/20 0.68
▸ P4HB P07237 1/20 0.55
▸ XDH P47989 2/20 0.53
▸ SYNJ2 O15056 3/20 0.53
▸ APP P05067 1/20 0.53

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
SCHEMBL30291877 0.92 MAPT (0.62) CYP3A4ALOX15MAPTHSD17B10RECQL
SCHEMBL29638142 0.84 CBS (0.56) CYP3A4ALOX15MAPTHSD17B10RECQL
SCHEMBL30915482 0.83 CYP2C9 (0.58) CYP3A4ALOX15MAPTHSD17B10RECQL
SCHEMBL30915483 0.83 CYP2C9 (0.58) CYP3A4ALOX15MAPTHSD17B10RECQL
(+)-Taxifolin SCHEMBL18131936 0.82 CYP3A4 (0.90) CYP3A4ALOX15MAPTHSD17B10RECQL
(+)-Taxifolin SCHEMBL296323 0.82 CYP3A4 (1.00) CYP3A4ALOX15MAPTHSD17B10RECQL
(+)-Taxifolin SCHEMBL13241264 0.82 CYP3A4 (1.00) CYP3A4ALOX15MAPTHSD17B10RECQL
(+)-Taxifolin SCHEMBL1707803 0.82 CYP3A4 (1.00) CYP3A4ALOX15MAPTHSD17B10RECQL
(+)-Taxifolin SCHEMBL7628142 0.82 CYP3A4 (1.00) CYP3A4ALOX15MAPTHSD17B10RECQL
(+)-Epitaxifolin SCHEMBL31575455 0.82 CYP3A4 (1.00) CYP3A4ALOX15MAPTHSD17B10RECQL

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
CN-110441439-B Metabolism marker for distinguishing taxus mairei and taxus yunnanensis and detection method thereof 杭州师范大学 2022-03-01 — — CN disclosed
CN-110441439-B Metabolism marker for distinguishing taxus mairei and taxus yunnanensis and detection method thereof 杭州师范大学 2022-03-01 — — CN disclosed
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