Sulfuric Acid

Sulfuric Acid

SCHEMBL28282145

Cc1ccc(N)c(C)c1.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O

nearest known ligand 0.50

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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
TDP1 Q9NUW8 6/20 0.50
CYP3A4 P08684 5/20 0.50
ALOX15 P16050 4/20 0.50
THRB P10828 4/20 0.50
TP53 P04637 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 7/20 0.48
TSHR P16473 3/20 0.48
MAPT P10636 4/20 0.45
KDM4E B2RXH2 2/20 0.45
GAA P10253 2/20 0.45
HSD17B10 Q99714 2/20 0.45
LMNA P02545 1/20 0.45
RECQL P46063 2/20 0.44
MEN1 O00255 1/20 0.44
PKM P14618 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
HPGD P15428 1/20 0.44
CASP1 P29466 1/20 0.44

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 SCHEMBL28204624 1.00 TDP1 (0.50) TDP1CYP3A4ALOX15THRBTP53
SCHEMBL28282146 0.88 TDP1 (0.43) TDP1CYP3A4ALOX15THRBTP53
Methyl Alcohol SCHEMBL11681113 0.86 TDP1 (0.59) TDP1CYP3A4ALOX15THRBTP53
SCHEMBL33980 0.86
SCHEMBL29366708 0.86
Sulfuric Acid SCHEMBL209880 0.84 ALOX15 (0.73) TDP1CYP3A4ALOX15THRBTP53
Ammonia Solution, Strong SCHEMBL1548755 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53
Hydrochloric Acid SCHEMBL2861056 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53
SCHEMBL11239230 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53
Fluoride SCHEMBL18789317 0.84 TDP1 (0.62) TDP1CYP3A4ALOX15THRBTP53

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-109517757-A One plant of manganese oxidation Aeromonas hydrophila DS02 and its application 广西大学 2019-03-26 CN disclosed