Sulfuric Acid

Sulfuric Acid

SCHEMBL28043647

CCCCCS(=O)(=O)O.O=S(=O)(O)O.c1c[nH]cn1

nearest known ligand 0.42

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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 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
FKBP5 Q13451 1/20 0.42
EPHX2 P34913 1/20 0.37
TP53 P04637 1/20 0.33
FAAH O00519 2/20 0.32
S1PR2 O95136 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
HTT P42858 1/20 0.31
APP P05067 1/20 0.31
CA2 P00918 1/20 0.30

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 SCHEMBL28762297 0.98 ALDH1A1 (0.41) ALDH1A1FKBP5EPHX2TP53FAAH
Imidazole SCHEMBL2544230 0.98 ALDH1A1 (0.43) ALDH1A1FKBP5EPHX2TP53FAAH
Imidazole SCHEMBL28160742 0.97 ALDH1A1 (0.42) ALDH1A1FKBP5EPHX2FAAHS1PR2
Sulfuric Acid SCHEMBL28029793 0.95 ALDH1A1 (0.43) ALDH1A1FKBP5EPHX2TP53S1PR2
Imidazole SCHEMBL6011845 0.93 ALDH1A1 (0.45) ALDH1A1FKBP5EPHX2S1PR2S1PR1
Imidazole SCHEMBL28861231 0.92 ALDH1A1 (0.43) ALDH1A1FKBP5EPHX2S1PR2S1PR1
Sulfuric Acid SCHEMBL28002343 0.88 ALDH1A1 (0.46) ALDH1A1FKBP5
Imidazole SCHEMBL6011858 0.86 ALDH1A1 (0.48) ALDH1A1FKBP5
Trifluoromethanesulfonic Acid SCHEMBL28799200 0.85 ALDH1A1 (0.37) ALDH1A1FKBP5
Imidazole SCHEMBL1006548 0.82 ALDH1A1 (0.56) ALDH1A1FKBP5

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-105097294-A Polyarylether/ionic liquid composite membrane used for supercapacitor and preparation method for polyarylether/ionic liquid composite membrane UNIV JILIN 2015-11-25 CN disclosed