Sulfuric Acid

Sulfuric Acid

SCHEMBL2965710

C=C(C)C(=O)OCCc1ccccc1C(C)(C)N.O=S(=O)(O)O

nearest known ligand 0.37

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Sulfuric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.37
ALOX5 P09917 2/20 0.36
TDP1 Q9NUW8 2/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TSHR P16473 2/20 0.33
ATM Q13315 1/20 0.32
CA2 P00918 3/20 0.31
CA1 P00915 2/20 0.31
TYR P14679 1/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
ELANE P08246 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
SCHEMBL3453068 0.95 THRB (0.41) THRBALOX5TDP1POLBAPEX1
SCHEMBL2252926 0.94 ALOX5 (0.36) THRBALOX5TDP1POLBAPEX1
Iodide SCHEMBL2252207 0.94 THRB (0.40) THRBALOX5TDP1POLBAPEX1
Bromide SCHEMBL2250528 0.94 THRB (0.40) THRBALOX5TDP1POLBAPEX1
Hydrochloric Acid SCHEMBL1191038 0.94 THRB (0.40) THRBALOX5TDP1POLBAPEX1
Sulfuric Acid SCHEMBL2793234 0.82 THRB (0.45) THRBALOX5TSHRTYRPPARG
SCHEMBL11693537 0.80 THRB (0.41) THRBALOX5TDP1POLBAPEX1
SCHEMBL30530483 0.80 THRB (0.41) THRBALOX5TDP1POLBAPEX1
SCHEMBL9354401 0.79 THRB (0.42) THRBALOX5TDP1POLBAPEX1
SCHEMBL2256992 0.77 ALOX5 (0.43) THRBALOX5TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120132843-A1 USE OF COMPOSITE MATERIALS BASED ON CARBON NANOTUBES AS THICKENING AGENTS FOR AQUEOUS SOLUTIONS C.N.R.S. (FR) 2012-05-31 US claimed
US-7772340-B2 Alkoxyamines originating from β-phoshorated nitroxides and use thereof in radical polymerisation ARKEMA FRANCE (FR) 2010-08-10 US claimed
US-7635740-B2 Method for radical emulsion polymerisation using hydrosoluble alkoxyamines ARKEMA FRANCE (FR) 2009-12-22 US claimed
US-20070123669-A1 Method for radical emulsion polymerisation using hydrosoluble alkoxyamines ARKEMA FRANCE (FR) 2007-05-31 US claimed