Sulfuric Acid

Sulfuric Acid

SCHEMBL8910597

O=C(O)C(Cc1ccc(Oc2ccc(O)cc2)cc1)NI.O=S(=O)(O)O

nearest known ligand 0.48

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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 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
FOLH1 Q04609 1/20 0.45
NAALAD2 Q9Y3Q0 1/20 0.45
MME P08473 4/20 0.44
ACE P12821 4/20 0.44
CPA1 P15085 2/20 0.44
ACE2 Q9BYF1 2/20 0.44
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
ENPEP Q07075 2/20 0.42
PCNA P12004 1/20 0.42
SLC7A5 Q01650 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
Sulfuric Acid SCHEMBL8910593 1.00 MEN1 (0.48) MEN1KMT2AL3MBTL1CA1CA2
SCHEMBL188398 0.94 FOLH1 (0.49) MEN1KMT2AL3MBTL1CA1CA2
SCHEMBL188399 0.94 FOLH1 (0.49) MEN1KMT2AL3MBTL1CA1CA2
SCHEMBL28520123 0.93 FOLH1 (0.48) MEN1KMT2AL3MBTL1CA1CA2
Carbamic Acid SCHEMBL7215414 0.90 SLC7A5 (0.46) MEN1KMT2AL3MBTL1CA1CA2
SCHEMBL8910599 0.86 KDM4E (0.46) CA2MMEACECPA1ACE2
SCHEMBL55972 0.85 FOLH1 (0.56) MEN1KMT2AL3MBTL1CA1CA2
SCHEMBL55971 0.85 FOLH1 (0.56) MEN1KMT2AL3MBTL1CA1CA2
SCHEMBL3105902 0.85 FOLH1 (0.56) MEN1KMT2AL3MBTL1CA1CA2
Methane SCHEMBL4610737 0.84 FOLH1 (0.55) MEN1KMT2AL3MBTL1CA1CA2

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
US-5670380-A QUANTITATIVE ANALYSIS OF PREGNANT WOMEN VETERANS AFFAIRS, DEPARTMENT OF 1997-09-23 US disclosed