Sulfuric Acid

Sulfuric Acid

SCHEMBL2854050

Nc1cnn(CCO)c1N.O=S(=O)(O)O.O=S(=O)(O)O

nearest known ligand 0.36

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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 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.36

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 SCHEMBL8919999 0.98 CYP1A2 (0.35) CYP1A2
SCHEMBL33881 0.91 CYP1A2 (0.42) CYP1A2
Hydrochloric Acid SCHEMBL6030708 0.89 CYP1A2 (0.41) CYP1A2
Hydrochloric Acid SCHEMBL19549166 0.89 CYP1A2 (0.41) CYP1A2
Sulfuric Acid SCHEMBL5493743 0.84
SCHEMBL3952062 0.82 CYP1A2 (0.36) CYP1A2
SCHEMBL1802152 0.82 LMNA (0.31)
Sulfuric Acid SCHEMBL5278578 0.80 CYP1A2 (0.33) CYP1A2
SCHEMBL5398725 0.79 ADORA2A (0.33) CYP1A2
SCHEMBL5419030 0.79 APP (0.35)

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
EP-1652554-B1 Composition comprising at least one carboycanine, process of treating keratinic fibres, kit and use of said composition OREAL (FR) 2010-01-13 EP disclosed