Diallyldisulfide

Diallyldisulfide

SCHEMBL2813704

C=CCS.C=CCSSCC=C

nearest known ligand 0.73

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Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.73
ALDH1A1 P00352 2/20 0.73
CYP3A4 P08684 2/20 0.73
HPGD P15428 2/20 0.73
ALOX15 P16050 1/20 0.73
ALOX5 P09917 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PTGS2 P35354 1/20 0.33
TERT O14746 1/20 0.31
MDM4 O15151 1/20 0.31
TP53 P04637 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
SLC25A21 Q9BQT8 1/20 0.31

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
Diallyldisulfide SCHEMBL18687005 0.86 TRPA1 (1.00) TRPA1ALDH1A1CYP3A4HPGDALOX15
Diallyldisulfide SCHEMBL93944 0.86
SCHEMBL10658123 0.84
SCHEMBL3659058 0.79 TRPA1 (0.46) TRPA1ALDH1A1CYP3A4HPGDALOX15
Diallyldisulfide SCHEMBL9398506 0.79 TRPA1 (0.85) TRPA1ALDH1A1CYP3A4HPGDALOX15
SCHEMBL21461 0.78
Hydrogen Sulfide SCHEMBL25430738 0.73
SCHEMBL11567815 0.73
Methane SCHEMBL21683041 0.73
Phosphine SCHEMBL8825861 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117730635-A Photoelectric conversion element and solar cell module 株式会社理光 2024-03-19 CN disclosed
CN-101965652-B Dye sensitised solar cell BASF SE 2014-11-26 CN disclosed
CN-102194574-A Photoelectric conversion device SONY CORP 2011-09-21 CN disclosed
CN-101965652-A Dye sensitised solar cell BASF SE 2011-02-02 CN disclosed
US-20100300529-A1 DYE-SENSITIZED SOLAR CELL KONICA MINOLTA HOLDINGS, INC. (JP) 2010-12-02 US disclosed