2-Mercaptoethanol

2-Mercaptoethanol

SCHEMBL6558446

Cc1cc(C)c(S(=O)(=O)Cl)c(C)c1S(=O)(=O)Cl.OCCS

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA12 O43570 1/20 0.33
CA4 P22748 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA13 Q8N1Q1 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
MMP13 P45452 1/20 0.32
RAPGEF4 Q8WZA2 1/20 0.32
FABP4 P15090 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL2263745 0.84 RAPGEF4 (0.40) CA1CA2CA12CA4CA7
SCHEMBL6557356 0.77 RAPGEF4 (0.33) ALDH1A1CA1CA2CA12CA4
SCHEMBL7313649 0.76 RAPGEF4 (0.38) CA1CA2CA12CA4CA7
SCHEMBL14411559 0.71 CA1 (0.38) ALDH1A1CA1CA2CA12CA4
SCHEMBL1021882 0.71 KMT2A (0.44) ALDH1A1RAPGEF4FABP4LMNAGAA
SCHEMBL6557490 0.70 CA12 (0.35) CA1CA2CA12CA4CA7
SCHEMBL14958764 0.68 TSHR (0.44) ALDH1A1CA1CA2CA4LMNA
SCHEMBL13649887 0.67 CYP3A4 (0.48) ALDH1A1CA1CA2CA12CA4
2-Mercaptoethanol SCHEMBL6557176 0.67 ALDH1A1 (0.48) ALDH1A1CA1CA2CA12CA4
SCHEMBL28643737 0.67 ALDH1A1 (0.30) ALDH1A1

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-0916394-B1 Method of manufacturing modified particles and manufacturing device therefor SHARP KK (JP) 2004-03-10 EP disclosed
US-6194487-B1 EXPOSURE OF PARTICLES TO SUPERSATURATED VAPOR OF MONOMERS, CONDENSATION AND POLYMERIZATION ON THE SURFACE SHARP KABUSHIKI KAISHA (JP) 2001-02-27 US disclosed
EP-0916394-A2 Method of manufacturing modified particles and manufacturing device therefor Sharp Kabushiki Kaisha (JP) 1999-05-19 EP disclosed