Sulfuric Acid

Sulfuric Acid

SCHEMBL2672044

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

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

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
OPRK1 known ✓ P41145 1/20 0.36
CHRM2 known ✓ P08172 2/20 0.35
CHRM1 known ✓ P11229 2/20 0.35
CHRM3 known ✓ P20309 2/20 0.35
SCN4A known ✓ P35499 1/20 0.32
SCN5A known ✓ Q14524 1/20 0.32
SCN9A known ✓ Q15858 1/20 0.32
SCN3A known ✓ Q9NY46 1/20 0.32
NPSR1 Q6W5P4 2/20 0.38
PAOX Q6QHF9 1/20 0.37
ALDH1A1 P00352 6/20 0.36
TDP1 Q9NUW8 1/20 0.36
CHRM4 P08173 2/20 0.35
CHRM5 P08912 2/20 0.35
TRPA1 O75762 1/20 0.35
MAPT P10636 3/20 0.33
KDM4E B2RXH2 1/20 0.33
AGTR1 P30556 1/20 0.33
LMNA P02545 2/20 0.32
CYP3A4 P08684 1/20 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
SCHEMBL442212 0.89
Sulfuric Acid SCHEMBL11850568 0.87 TRPA1 (0.40) ALDH1A1TDP1TRPA1CA5ACA5B
Hydrochloric Acid SCHEMBL2672201 0.87 ALDH1A1 (0.42) NPSR1PAOXALDH1A1TDP1OPRK1
Acetic Acid SCHEMBL2672332 0.84 ALDH1A1 (0.40) NPSR1PAOXALDH1A1TDP1OPRK1
SCHEMBL20067016 0.84 ALDH1A1 (0.44) PAOXALDH1A1TDP1OPRK1CHRM2
Sulfuric Acid SCHEMBL78884 0.78 NPSR1 (0.46) NPSR1PAOXALDH1A1TDP1CHRM2
Sulfuric Acid SCHEMBL11137355 0.78 NPSR1 (0.46) NPSR1PAOXALDH1A1TDP1CHRM2
Sulfuric Acid SCHEMBL29289482 0.78 NPSR1 (0.46) NPSR1PAOXALDH1A1TDP1CHRM2
Sulfuric Acid SCHEMBL11137352 0.78 NPSR1 (0.46) NPSR1PAOXALDH1A1TDP1CHRM2
Sulfuric Acid SCHEMBL16059228 0.78 NPSR1 (0.46) NPSR1PAOXALDH1A1TDP1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046933-B1 DETERGENT COMPOSITION RECKITT BENCKISER NV (NL) 2015-07-15 EP disclosed
US-8173587-B2 Detergent composition RECKITT BENCKISER N.V. (NL) 2012-05-08 US disclosed
US-20090325840-A1 Detergent Composition RECKITT BENCKISER N.V. (NL) 2009-12-31 US disclosed
EP-2049643-A1 USE OF AMINOACETONES AND SALTS THEREOF AS BLEACHING BOOSTERS FOR PEROXYGEN COMPOUNDS Clariant Finance (BVI) Limited (VG) 2009-04-22 EP disclosed
EP-2046933-A1 DETERGENT COMPOSITION Reckitt Benckiser N.V. (NL) 2009-04-15 EP disclosed
WO-2008015443-A1 DETERGENT COMPOSITION RECKITT BENCKISER N.V. (NL) 2008-02-07 WO disclosed
WO-2008014965-A1 USE OF AMINOACETONES AND SALTS THEREOF AS BLEACHING BOOSTERS FOR PEROXYGEN COMPOUNDS CLARIANT FINANCE (BVI) LIMITED (VG) 2008-02-07 WO disclosed