Sulfuric Acid

Sulfuric Acid

SCHEMBL27796641

O=S(=O)([O-])[O-].[Na+].[Na+].c1ccc(CCOc2ccccc2)cc1

nearest known ligand 0.68

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Known targets — ChEMBL curated mechanism

dacAdacBdacCftsImrcAmrcBmrdA

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 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.68
CA2 P00918 2/20 0.68
CA9 Q16790 2/20 0.68
CA12 O43570 1/20 0.68
CA7 P43166 1/20 0.68
FFAR1 O14842 4/20 0.60
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
GAA P10253 1/20 0.51
DRD2 P14416 1/20 0.50
DRD4 P21917 1/20 0.50
DRD3 P35462 1/20 0.50
LTA4H P09960 1/20 0.50
KCNA3 P22001 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
ALOX5 P09917 1/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46

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 SCHEMBL6832154 0.87 CA1 (0.65) CA1CA2CA9CA12CA7
SCHEMBL1070131 0.86 NPC1 (0.73) CA1CA2CA9CA12CA7
SCHEMBL10708208 0.84 CA1 (0.76) CA1CA2CA9CA12CA7
Methane SCHEMBL28866356 0.82 NPC1 (0.68) CA1CA2CA9CA12CA7
SCHEMBL9456979 0.82 NPC1 (0.80) CA1CA2CA9CA12CA7
SCHEMBL11857770 0.79 NPC1 (0.69) CA1CA2CA9CA12CA7
SCHEMBL10904942 0.77 CA12 (0.66) CA1CA2CA9CA12CA7
SCHEMBL28544131 0.77 FFAR1 (0.59) CA1CA2CA9CA12CA7
Anisole SCHEMBL28822365 0.77 NPC1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL2093399 0.77 NPC1 (0.67) CA1CA2CA9CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105064016-A Flame retardant for textile materials, preparation method thereof and prepared flame-retardant textile material WUXI CHANGAN SHUGUANG GLOVE FACTORY 2015-11-18 CN disclosed
CN-101631910-B Flameproofing agent, flame-retardant fiber and method for producing the same MATSUMOTO YUSHI SEIYAKU KK 2013-05-22 CN disclosed
CN-101631910-A Flameproofing agent, flame-retardant fiber and method for producing the same MATSUMOTO YUSHI SEIYAKU KK 2010-01-20 CN disclosed