Dithioerythriol

Dithioerythriol

SCHEMBL9109286

O=C(O)CS.OC[C@@H](O)[C@@H](S)CS

nearest known ligand 0.37

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Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.37
LMNA P02545 4/20 0.35
TDP1 Q9NUW8 2/20 0.35
NR1I2 O75469 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
HTT P42858 1/20 0.35
HSD17B10 Q99714 1/20 0.35
USP2 O75604 1/20 0.34
SLCO1B1 Q9Y6L6 1/20 0.34
OR51E2 Q9H255 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ANPEP P15144 2/20 0.31
ENPEP Q07075 2/20 0.31
FOLH1 Q04609 1/20 0.31
PTGS1 P23219 1/20 0.31
SLC7A11 Q9UPY5 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
Dithioerythriol SCHEMBL7523387 1.00 PDE4A (0.37) PDE4ALMNATDP1NR1I2ALDH1A1
Dithioerythriol SCHEMBL16566794 0.86 PDE4A (0.37) PDE4ALMNATDP1NR1I2ALDH1A1
Dithioerythriol SCHEMBL15611744 0.85
Dithioerythriol SCHEMBL78922 0.85
Dithioerythriol SCHEMBL10602 0.85
Dithioerythriol SCHEMBL3422787 0.83
Dithioerythriol SCHEMBL9773254 0.83
E968 SCHEMBL28445480 0.83 PDE4A (0.44) PDE4ALMNATDP1USP2SLCO1B1
E968 SCHEMBL9858617 0.83 PDE4A (0.44) PDE4ALMNATDP1USP2SLCO1B1
E968 SCHEMBL10703757 0.83 PDE4A (0.44) PDE4ALMNATDP1USP2SLCO1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0586693-A4 TECHNIQUE FOR PREVENTION OF FALSE REACTIONS IN IMMUNOLOGICAL TESTING. MONTEFIORE MED CENTER (US) 1995-01-25 EP disclosed
EP-0586693-A1 TECHNIQUE FOR PREVENTION OF FALSE REACTIONS IN IMMUNOLOGICAL TESTING MONTEFIORE MEDICAL CENTER (US) 1994-03-16 EP disclosed
WO-1993019369-A1 TECHNIQUE FOR PREVENTION OF FALSE REACTIONS IN IMMUNOLOGICAL TESTING MONTEFIORE MEDICAL CENTER (US) 1993-09-30 WO disclosed