Sulfuric Acid

Sulfuric Acid

SCHEMBL28060747

CO.O=S(=O)([O-])O.[K+]

nearest known ligand 0.00

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Known targets — ChEMBL curated mechanism

CYP51cyp51Acyp51c

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL28001027 0.91
Sulfuric Acid SCHEMBL5550096 0.91 TSHR (0.80)
Sulfuric Acid SCHEMBL7162371 0.91 TSHR (0.80)
Sulfuric Acid SCHEMBL35941 0.91
Sulfuric Acid SCHEMBL8524372 0.86 TSHR (0.73)
Sulfuric Acid SCHEMBL11906007 0.86
Sulfuric Acid SCHEMBL7140465 0.86
Sulfuric Acid SCHEMBL17294487 0.86
Sulfuric Acid SCHEMBL21409965 0.86 TSHR (0.73)
Sulfuric Acid SCHEMBL1302635 0.86 TSHR (0.73)

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-103003244-B Salts and solvates of tetrahydroisoquinoline derivatives NOVARTIS AG (CH) 2016-04-20 CN disclosed