Enterodiol

Enterodiol

SCHEMBL2806235

CC(Cc1ccccc1)C(C)Cc1ccccc1.OC[C@H](Cc1cccc(O)c1)[C@H](CO)Cc1cccc(O)c1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.59
OPRK1 P41145 4/20 0.43
OPRM1 P35372 2/20 0.43
OPRD1 P41143 2/20 0.43
CYP2D6 P10635 2/20 0.43
SLC6A2 P23975 4/20 0.42
ALOX15 P16050 3/20 0.42
ALOX12 P18054 3/20 0.42
CYP3A4 P08684 3/20 0.42
SLC6A3 Q01959 3/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
ESR1 P03372 2/20 0.42
TP53 P04637 2/20 0.42
HPGD P15428 2/20 0.42
MAPK1 P28482 2/20 0.42
RECQL P46063 2/20 0.42
KMT2A Q03164 2/20 0.42
HIF1A Q16665 2/20 0.42

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
Enterodiol SCHEMBL31171980 0.87 ENPP2 (0.52) OPRK1CYP2D6SLC6A2ALOX15CYP3A4
Enterodiol SCHEMBL30334906 0.87 ENPP2 (0.52) OPRK1CYP2D6SLC6A2ALOX15CYP3A4
Enterodiol SCHEMBL11271740 0.87 ENPP2 (0.52) OPRK1CYP2D6SLC6A2ALOX15CYP3A4
Enterodiol SCHEMBL120183 0.87 ENPP2 (0.52) OPRK1CYP2D6SLC6A2ALOX15CYP3A4
Enterodiol SCHEMBL2641390 0.87 ENPP2 (0.52) OPRK1CYP2D6SLC6A2ALOX15CYP3A4
Enterodiol SCHEMBL31171979 0.87 ENPP2 (0.52) OPRK1CYP2D6SLC6A2ALOX15CYP3A4
Enterodiol SCHEMBL31171993 0.87 ENPP2 (0.52) OPRK1CYP2D6SLC6A2ALOX15CYP3A4
SCHEMBL4531632 0.85 ALOX15 (0.55) TRPA1OPRK1OPRM1OPRD1CYP2D6
Enterodiol SCHEMBL2987870 0.83 OPRK1 (0.52) OPRK1OPRM1OPRD1CHRM1DRD2
SCHEMBL1889290 0.79 TRPA1 (0.70) TRPA1CYP2D6SLC6A2CYP3A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180353441-A1 COMPOSITIONS AND METHODS FOR TREATING LUNG DISEASES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2018-12-13 US claimed
US-20110300247-A1 FLAXSEED LIGNAN COMPLEX AND ITS USE THEREOF THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2011-12-08 US claimed
US-20100239696-A1 FLAXSEED LIGNAN COMPLEX, METHODS OF USING AMD COMPOSITIONS THEREOF THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2010-09-23 US claimed
CN-113845967-A Method for reducing acid value of sesame product prepared from germinated sesame 丰益(上海)生物技术研发中心有限公司 2021-12-28 CN disclosed
US-20180280462-A1 USE OF FLAXSEED AND FLAXSEED DERIVATIVES FOR TREATMENT OF NEUROLOGICAL DISORDERS AND VIRAL DISEASES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2018-10-04 US disclosed
US-9987321-B2 Use of flaxseed and flaxseed derivatives for treatment of neurological disorders and viral diseases THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2018-06-05 US disclosed
US-20140308379-A1 USE OF FLAXSEED AND FLAXSEED DERIVATIVES FOR TREATMENT OF NEUROLOGICAL DISORDERS AND VIRAL DISEASES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2014-10-16 US disclosed