Sulfuric Acid

Sulfuric Acid

SCHEMBL11560480

C=CCN=C(N)NC.O=S(=O)(O)O

nearest known ligand 0.34

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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 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.32
BLM P54132 1/20 0.31
KDM4E B2RXH2 1/20 0.31
DDAH1 O94760 1/20 0.31
NOS1 P29475 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 SCHEMBL11560479 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10BLMKDM4EDDAH1
Sulfuric Acid SCHEMBL8346498 0.77 BLM (0.43) BLMKDM4E
Sulfuric Acid SCHEMBL11563444 0.72 ADRA2A (0.42) HSD17B10BLMKDM4ENOS1
Sulfuric Acid SCHEMBL11563439 0.72 ADRA2A (0.42) HSD17B10BLMKDM4ENOS1
SCHEMBL1627388 0.70
Sulfuric Acid SCHEMBL11565555 0.69 GRIN2D (0.53) HSD17B10BLMDDAH1
Sulfuric Acid SCHEMBL11562590 0.69 HSD17B10 (0.32) HSD17B10BLMKDM4ENOS1
Sulfuric Acid SCHEMBL11565557 0.69 GRIN2D (0.53) HSD17B10BLMDDAH1
Sulfuric Acid SCHEMBL11562593 0.69 HSD17B10 (0.32) HSD17B10BLMKDM4ENOS1
SCHEMBL26157971 0.69

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-4147804-A ANTIARRHYTHMIA AGENTS WILLIAM H. RORER, INC. (US) 1979-04-03 US disclosed