Sulfuric Acid

Sulfuric Acid

SCHEMBL28557396

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

nearest known ligand 0.42

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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 20)

geneUniProtsupporting neighboursconfidence
ADRA1A known ✓ P35348 1/20 0.37
TP53 P04637 1/20 0.42
CA5A P35218 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
ALDH1A1 P00352 1/20 0.39
BLM P54132 4/20 0.38
CYP2C19 P33261 3/20 0.38
LMNA P02545 1/20 0.38
SLC6A6 P31641 1/20 0.38
CACNA2D1 P54289 2/20 0.37
CACNB3 P54284 1/20 0.37
CACNA1C Q13936 1/20 0.37
PGR P06401 1/20 0.37
HTR2B P41595 1/20 0.37
CACNA2D2 Q9NY47 1/20 0.37
GABBR2 O75899 1/20 0.36
GABBR1 Q9UBS5 1/20 0.36
TSHR P16473 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35

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
Sulfuric Acid SCHEMBL28623066 0.91 TP53 (0.38) TP53CA5ACA5BALDH1A1BLM
SCHEMBL27489947 0.90 ALDH1A1 (0.37) TP53CA5ACA5BALDH1A1BLM
Sulfuric Acid SCHEMBL28238705 0.84 TP53 (0.41) TP53CA5ACA5BALDH1A1BLM
Sulfuric Acid SCHEMBL11155340 0.84 ALDH1A1 (0.62) TP53CA5ACA5BALDH1A1BLM
Sulfuric Acid SCHEMBL2127327 0.84 TP53 (0.41) TP53CA5ACA5BALDH1A1BLM
Sulfuric Acid SCHEMBL11327555 0.84 ALDH1A1 (0.62) TP53CA5ACA5BALDH1A1BLM
SCHEMBL28621094 0.83 GABBR2 (0.38) TP53ALDH1A1BLMCYP2C19LMNA
Sulfuric Acid SCHEMBL8088341 0.81 TP53 (0.39) TP53CA5ACA5BALDH1A1BLM
Sulfuric Acid SCHEMBL10863257 0.81 ALDH1A1 (0.59) TP53CA5ACA5BALDH1A1BLM
Methyl Alcohol SCHEMBL27870275 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112852695-B Recombinant escherichia coli for producing isobutylamine as well as construction method and application thereof 中国科学院天津工业生物技术研究所 2021-12-03 CN disclosed
CN-112852695-A Recombinant escherichia coli for producing isobutylamine as well as construction method and application thereof 中国科学院天津工业生物技术研究所 2021-05-28 CN disclosed