2-Mercaptoethanol

2-Mercaptoethanol

SCHEMBL7908916

NS(=O)(=O)c1ccc(F)c2nonc12.OCCS

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 2/20 0.39
CA2 P00918 7/20 0.38
GSTP1 P09211 1/20 0.36
CHRM1 P11229 1/20 0.35
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
CA1 P00915 1/20 0.32
CA9 Q16790 1/20 0.32
IDO1 P14902 2/20 0.31
HTT P42858 1/20 0.31
FTO Q9C0B1 1/20 0.31
ALDH1A1 P00352 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 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
SCHEMBL571688 0.88 TET2 (0.46) TET2CA2CHRM1POLBKMT2A
SCHEMBL1271332 0.75 TET2 (0.46) TET2GSTP1CHRM1TP53POLB
Ammonia Solution, Strong SCHEMBL591415 0.73 TET2 (0.45) TET2GSTP1CHRM1TP53POLB
SCHEMBL2530974 0.73 POLB (0.40) TET2GSTP1CHRM1TP53POLB
SCHEMBL10693669 0.72 POLB (0.37) TET2GSTP1CHRM1TP53POLB
SCHEMBL3761809 0.71 GSTP1 (0.46) CA2GSTP1CA1CA9
SCHEMBL14008404 0.71 POLB (0.35) TET2CHRM1POLBKMT2AALDH1A1
SCHEMBL2728455 0.70 MEN1 (0.41) CA2POLBKMT2ACA1CA9
SCHEMBL7752552 0.68 RORA (0.46) CA2TP53POLBCA1CA9
SCHEMBL1893522 0.68 HDAC4 (0.45) CHRM1POLBKMT2AHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6197258-B1 DETECTOR FOR DETERMINING AQUEOUS METAL ION CONCENTRATION INCLUDING A PHOTOLUMINESCENT LABEL BOUND TO AN ANALYTE BINDING MACROMOLECULE OF HUMAN APOCARBONIC ANHYDRASE OR DERIVATIVE UNIVERSITY OF MARYLAND, BALTIMORE 2001-03-06 US disclosed