Sulfuric Acid

Sulfuric Acid

SCHEMBL9048559

C=Cc1cccc(O)c1O.O=S(=O)(O)O

nearest known ligand 0.55

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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
ERN1 O75460 1/20 0.55
POLB P06746 3/20 0.48
GAA P10253 3/20 0.48
RAB9A P51151 1/20 0.48
IAPP P10997 4/20 0.46
NOX4 Q9NPH5 1/20 0.43
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
ALOX15 P16050 2/20 0.42
HSD17B10 Q99714 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
ADAMTS4 O75173 1/20 0.42
EGFR P00533 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
LMNA P02545 1/20 0.42
FYN P06241 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42

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
SCHEMBL131222 0.89 ERN1 (0.60) ERN1POLBGAARAB9AIAPP
SCHEMBL29356117 0.89 ERN1 (0.60) ERN1POLBGAARAB9AIAPP
Acetone SCHEMBL22719929 0.84 ERN1 (0.61) ERN1POLBGAARAB9AIAPP
Sulfuric Acid SCHEMBL8445673 0.83 TRIM24 (0.52) ERN1ALDH1A1HSD17B10CA1CA2
Ethylene Glycol SCHEMBL17292672 0.82 ERN1 (0.52) ERN1POLBGAARAB9AIAPP
Acetic Acid SCHEMBL724536 0.81 ERN1 (0.57) ERN1POLBGAARAB9AIAPP
Pyrogallol SCHEMBL27910417 0.79 ALDH1A1 (0.57) ERN1POLBGAARAB9AIAPP
SCHEMBL7774684 0.78 ERN1 (0.39) ERN1POLBGAARAB9AIAPP
SCHEMBL8336774 0.78 TTR (0.39) ERN1ALDH1A1TDP1CDK2
Sulfuric Acid SCHEMBL968452 0.78 ALDH1A1 (0.48) POLBGAAALDH1A1HPGDALOX15

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
JP-8012644-A None JP disclosed
JP-H0812644-A STYRENE SULFATE ESTER DERIVATIVE RES DEV CORP OF JAPAN 1996-01-16 JP disclosed