Sulfuric Acid

Sulfuric Acid

SCHEMBL7630477

COc1ccc(N)cc1.COc1ccc(N)cc1.O=S(=O)(O)O

nearest known ligand 0.73

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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 2/20 0.73
MAPK1 P28482 1/20 0.73
ALDH1A1 P00352 3/20 0.70
CYP3A4 P08684 1/20 0.70
APP P05067 2/20 0.57
NR4A1 P22736 1/20 0.57
CA1 P00915 5/20 0.54
CA2 P00918 5/20 0.54
CA9 Q16790 2/20 0.54
PKM P14618 2/20 0.52
CA12 O43570 1/20 0.50
CA7 P43166 1/20 0.50
CA14 Q9ULX7 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
F2 P00734 2/20 0.48
PRSS1 P07477 2/20 0.48
PRSS2 P07478 2/20 0.48
PRSS3 P35030 2/20 0.48
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.48

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 SCHEMBL9505045 1.00 TDP1 (0.73) TDP1MAPK1ALDH1A1CYP3A4APP
Sulfuric Acid SCHEMBL29722524 0.89 NR4A1 (0.79) TDP1MAPK1ALDH1A1CYP3A4APP
Sulfuric Acid SCHEMBL11419340 0.89 NR4A1 (0.79) TDP1MAPK1ALDH1A1CYP3A4APP
SCHEMBL11052026 0.88 ALDH1A1 (0.69) TDP1MAPK1ALDH1A1CYP3A4APP
SCHEMBL22462568 0.86 TDP1 (0.73) TDP1MAPK1ALDH1A1CYP3A4APP
Trifluoromethanesulfonic Acid SCHEMBL4812154 0.86 TDP1 (0.59) TDP1MAPK1ALDH1A1CYP3A4APP
Hydrogen Peroxide SCHEMBL7094445 0.85 TDP1 (0.89) TDP1MAPK1ALDH1A1CYP3A4APP
Methyl Alcohol SCHEMBL11502051 0.85 TDP1 (0.89) TDP1MAPK1ALDH1A1CYP3A4APP
Methyl Alcohol SCHEMBL27721382 0.85 TDP1 (0.89) TDP1MAPK1ALDH1A1CYP3A4APP
SCHEMBL5097 0.85

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
US-6451560-B1 PROKARYOTIC EXPRESSION SYSTEM CHARACTERIZED BY ALTERATIONS TO THE DLT OPERON WHEREBY EXPRESSION OF GENES ENCODED THEREIN MAY BE REGULATED TO LIMIT THE AVAILABILITY OF POLYPEPTIDES ENCODED BY SAID GENES. HARWOOD COLIN R (GB) 2002-09-17 US disclosed
EP-1095135-A2 PROTEIN SECRETION FROM BACTERIA HAVING REDUCED EXPRESSION OF A PRODUCT ENCODED BY THE DLT OPERON Newcastle University Ventures Limited (GB) 2001-05-02 EP disclosed
WO-2000003010-A2 PROTEIN SECRETION FROM BACTERIA HAVING REDUCED EXPRESSION OF A PRODUCT ENCODED BY THE DLT OPERON NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) 2000-01-20 WO disclosed