Sulfuric Acid

Sulfuric Acid

SCHEMBL7120165

CCN(CC)c1ccc(N)cc1C.O=S(=O)(O)O

nearest known ligand 0.46

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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
GAA P10253 2/20 0.45
L3MBTL1 Q9Y468 3/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 4/20 0.40
TSHR P16473 3/20 0.40
CYP3A4 P08684 2/20 0.40
RECQL P46063 2/20 0.40
PSMD14 O00487 1/20 0.40
MAPK1 P28482 1/20 0.40
GFER P55789 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PDE10A Q9Y233 1/20 0.40
CASP1 P29466 2/20 0.40
HPGD P15428 2/20 0.40
THRB P10828 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
S100B P04271 1/20 0.39
PRKCI P41743 1/20 0.38
ACHE P22303 2/20 0.37

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 SCHEMBL6566761 0.90 GAA (0.38) GAAL3MBTL1MAPTALDH1A1TSHR
SCHEMBL526857 0.89 ALDH1A1 (0.48) GAAL3MBTL1MAPTALDH1A1TSHR
Hydrochloric Acid SCHEMBL3336490 0.88 ALDH1A1 (0.47) GAAL3MBTL1MAPTALDH1A1TSHR
Hydrochloric Acid SCHEMBL9820908 0.88 ALDH1A1 (0.47) GAAL3MBTL1MAPTALDH1A1TSHR
Hydrochloric Acid SCHEMBL30338656 0.88 ALDH1A1 (0.47) GAAL3MBTL1MAPTALDH1A1TSHR
SCHEMBL11417011 0.87 ALDH1A1 (0.45) GAAL3MBTL1MAPTALDH1A1TSHR
Hydrochloric Acid SCHEMBL7079849 0.86 ALDH1A1 (0.45) GAAL3MBTL1MAPTALDH1A1TSHR
Sulfuric Acid SCHEMBL8444717 0.85 GAA (0.46) GAAL3MBTL1MAPTALDH1A1TSHR
Water SCHEMBL7079816 0.84 ALDH1A1 (0.44) GAAL3MBTL1MAPTALDH1A1TSHR
Sulfuric Acid SCHEMBL5699530 0.84 GAA (0.37) GAAL3MBTL1MAPTALDH1A1TSHR

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-6551767-B1 Forming a free-base and water mixture; heating free-base and water mixture to effect formation of a free-base layer and a water layer; separating liquid free-base layer from said water layer; mixing with water soluble solvent EASTMAN CHEMICAL COMPANY 2003-04-22 US disclosed