Sulfuric Acid

Sulfuric Acid

SCHEMBL9684336

CCN(CC)c1cccc(N)c1.O=S(=O)(O)O

nearest known ligand 0.53

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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 5/20 0.53
CYP3A4 P08684 5/20 0.53
TSHR P16473 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
HSD17B10 Q99714 2/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
RECQL P46063 3/20 0.46
PSMD14 O00487 1/20 0.46
MAPK1 P28482 1/20 0.46
GFER P55789 1/20 0.46
HPGD P15428 2/20 0.44
MEN1 O00255 1/20 0.44
HSP90AA1 P07900 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
S100B P04271 1/20 0.43
LMNA P02545 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39

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 SCHEMBL8754495 0.89 ALDH1A1 (0.43) ALDH1A1CYP3A4TSHRTDP1HSD17B10
SCHEMBL29931735 0.89 ALDH1A1 (0.59) ALDH1A1CYP3A4TSHRTDP1HSD17B10
SCHEMBL1413227 0.89 ALDH1A1 (0.59) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Hydrochloric Acid SCHEMBL6946148 0.87 CYP3A4 (0.57) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Sulfuric Acid SCHEMBL10705115 0.85 ALDH1A1 (0.44) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Iodide SCHEMBL5582206 0.84 CYP3A4 (0.53) ALDH1A1CYP3A4TSHRTDP1HSD17B10
SCHEMBL11441700 0.81 HSD17B10 (0.44) ALDH1A1CYP3A4TSHRTDP1HSD17B10
SCHEMBL11655314 0.81 ALDH1A1 (0.58) ALDH1A1CYP3A4TSHRTDP1HSD17B10
Sulfuric Acid SCHEMBL3336034 0.81 ALDH1A1 (0.82) ALDH1A1CYP3A4TSHRHSD17B10L3MBTL1
Sulfuric Acid SCHEMBL9277102 0.80 ALDH1A1 (0.50) ALDH1A1CYP3A4TSHRTDP1HSD17B10

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-0477402-A1 Agent for determining manganese and method relating thereto MILES INC. (US) 1992-04-01 EP disclosed