Sulfuric Acid

Sulfuric Acid

SCHEMBL28249244

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

nearest known ligand 0.36

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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 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
ZDHHC20 Q5W0Z9 2/20 0.32
ZDHHC2 Q9UIJ5 2/20 0.32

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
SCHEMBL329191 0.91
Trimethylammonium SCHEMBL16192843 0.89 ALDH1A1 (0.40) ALDH1A1TSHRZDHHC20ZDHHC2
Hydrochloric Acid SCHEMBL28755719 0.89
SCHEMBL28084768 0.83 ZDHHC20 (0.39) ALDH1A1TSHRZDHHC20ZDHHC2
SCHEMBL27814026 0.78 ALDH1A1 (0.31) ALDH1A1TSHR
SCHEMBL4552021 0.76 ZDHHC20 (0.41) ALDH1A1TSHRZDHHC20ZDHHC2
SCHEMBL2248756 0.75 ZDHHC20 (0.30) ZDHHC20ZDHHC2
SCHEMBL422311 0.74
SCHEMBL5037144 0.74 ALDH1A1 (0.38) ALDH1A1TSHRZDHHC20ZDHHC2
SCHEMBL3255350 0.74 ALDH1A1 (0.38) ALDH1A1TSHRZDHHC20ZDHHC2

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
CN-108602924-A Emulsion polymers and low VOC coating compositions prepared therefrom 阿科玛股份有限公司 2018-09-28 CN disclosed