Glycitein

Glycitein

SCHEMBL360612

COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O.O=c1c(-c2ccc(O)cc2)coc2cc(O)cc(O)c12.O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12.Oc1ccc([C@H]2COc3cc(O)ccc3C2)cc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR2

The experimentally established mechanism targets of Glycitein. 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
ESR2 known ✓ Q92731 3/20 0.47
HDAC6 Q9UBN7 4/20 0.56
RAB9A P51151 9/20 0.50
MAPT P10636 7/20 0.50
NPC1 O15118 7/20 0.50
KDM4E B2RXH2 6/20 0.50
POLB P06746 3/20 0.50
HMGB1 P09429 1/20 0.50
KLK7 P49862 1/20 0.49
ALDH2 P05091 2/20 0.48
TP53 P04637 6/20 0.47
SMN1; SMN2 Q16637 6/20 0.47
CYP2C9 P11712 5/20 0.47
CYP2C19 P33261 5/20 0.47
HPGD P15428 5/20 0.47
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
ALDH1A1 P00352 4/20 0.47
CYP3A4 P08684 4/20 0.47
MAOA P21397 4/20 0.47

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
Genistein SCHEMBL2436164 0.92 SMN1; SMN2 (0.56) HDAC6RAB9AMAPTNPC1KDM4E
Genistein SCHEMBL2432437 0.87 MAPT (0.61) HDAC6RAB9AMAPTNPC1KDM4E
Glycitein SCHEMBL4653829 0.87 HDAC6 (0.67) HDAC6RAB9AMAPTNPC1KDM4E
Glycitein SCHEMBL8065644 0.85 HDAC6 (0.78) HDAC6RAB9AMAPTNPC1KDM4E
Daidzein SCHEMBL3151489 0.85 KDM4E (0.61) HDAC6RAB9AMAPTNPC1KDM4E
Glycitein SCHEMBL3928329 0.82 HDAC6 (0.83) HDAC6RAB9AMAPTNPC1KDM4E
Glycitein SCHEMBL5483545 0.79 HDAC6 (0.91) HDAC6RAB9AMAPTNPC1KDM4E
Aus-131 SCHEMBL2004668 0.76 ESR1 (0.58) HDAC6RAB9AMAPTNPC1KDM4E
Formononetin SCHEMBL4223418 0.75 MAPT (0.83) HDAC6RAB9AMAPTNPC1KDM4E
Glycitein SCHEMBL6578666 0.75 RAB9A (0.85) HDAC6RAB9AMAPTNPC1KDM4E

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
EP-2593570-A2 FERMENTED SOYA BASED MIXTURE COMPRISING ISOFLAVONES- AGLICONES, EQUOL AND LUNASIL, PROCESS FOR THE PREPARATION AND USES THEREOF IN FOOD, MEDICAL AND COSMETIC FIELDS Giuliani S.p.A. (IT) 2013-05-22 EP disclosed
WO-2012007978-A2 FERMENTED SOYA BASED MIXTURE COMPRISING ISOFLAVONES- AGLICONES, EQUOL AND LUNASIL, PROCESS FOR THE PREPARATION AND USES THEREOF IN FOOD, MEDICAL AND COSMETIC FIELDS. GIULIANI S.P.A. (IT) 2012-01-19 WO disclosed