Sulfuric Acid

Sulfuric Acid

SCHEMBL28847019

CCc1c(N)ccc(N)c1CC.N.O=S(=O)(O)O

nearest known ligand 0.41

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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
ALDH1A1 P00352 4/20 0.41
GAA P10253 2/20 0.41
THRB P10828 2/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
RECQL P46063 1/20 0.41
CA2 P00918 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
NT5E P21589 1/20 0.33
POLB P06746 2/20 0.32

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 SCHEMBL1499856 0.98 ALDH1A1 (0.42) ALDH1A1GAATHRBTSHRHSD17B10
Sulfuric Acid SCHEMBL11415036 0.86 ALDH1A1 (0.35) ALDH1A1GAATHRBTSHRHSD17B10
Sulfuric Acid SCHEMBL4449582 0.85 ALDH1A1 (0.37) ALDH1A1GAATHRBTSHRHSD17B10
Sulfuric Acid SCHEMBL6417779 0.84 TTR (0.42) ALDH1A1GAATHRBTSHRHSD17B10
SCHEMBL7597804 0.84 AURKA (0.41) ALDH1A1GAATHRBTSHRHSD17B10
SCHEMBL21957780 0.84 ALDH1A1 (0.35) ALDH1A1GAATHRBTSHRHSD17B10
Hydroxyamine SCHEMBL28193821 0.83 NOS3 (0.38) ALDH1A1GAATHRBTSHRHSD17B10
SCHEMBL215981 0.83 NOS3 (0.41) ALDH1A1THRBTSHRHSD17B10MAPT
SCHEMBL30117633 0.83 NOS3 (0.41) ALDH1A1THRBTSHRHSD17B10MAPT
Sulfuric Acid SCHEMBL10628397 0.82 KDM4E (0.35) ALDH1A1GAATHRBTSHRHSD17B10

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-107036991-A A kind of chlorine dioxide and chlorite rapid analysis method based on ABTS 中山大学 2017-08-11 CN disclosed