Sulfuric Acid

Sulfuric Acid

SCHEMBL4285301

Cn1cnc2ccccc21.O=S(=O)(O)O

nearest known ligand 0.48

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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 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
HTT P42858 4/20 0.47
ALDH3A1 P30838 3/20 0.47
POLB P06746 1/20 0.47
NOD1 Q9Y239 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
EGLN3 Q9H6Z9 1/20 0.46
KMT2A Q03164 1/20 0.46
GRM5 P41594 1/20 0.45
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.43
APAF1 O14727 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42

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
SCHEMBL989450 0.95 TDP1 (0.47) TDP1HTTALDH3A1POLBNOD1
Trifluoromethanesulfonic Acid SCHEMBL2411761 0.89 ALDH3A1 (0.42) TDP1HTTALDH3A1POLBNOD1
SCHEMBL5399 0.88 TDP1 (0.59) TDP1HTTPOLBL3MBTL1EGLN3
SCHEMBL29359161 0.88 TDP1 (0.59) TDP1HTTPOLBL3MBTL1EGLN3
Hydrochloric Acid SCHEMBL7206595 0.86 TDP1 (0.57) TDP1HTTPOLBL3MBTL1EGLN3
Hydrochloric Acid SCHEMBL3713895 0.86 TDP1 (0.57) TDP1HTTPOLBL3MBTL1EGLN3
Iodide SCHEMBL15375366 0.86 TDP1 (0.57) TDP1HTTPOLBL3MBTL1EGLN3
Bromide SCHEMBL6955674 0.86 TDP1 (0.57) TDP1HTTPOLBL3MBTL1EGLN3
SCHEMBL28652434 0.86 TDP1 (0.57) TDP1HTTPOLBL3MBTL1EGLN3
Bromide SCHEMBL10432264 0.86 TDP1 (0.57) TDP1HTTPOLBL3MBTL1EGLN3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615644-B2 catalytic producing methanol from methane gas, by bubbling methane through the oxidation catalyst liquid mixture containing an imidazolium ionic liquid catalyst and a dissolved platinum compound as PtCl2, PtCl4, PtO2; cost efficiency, energy efficiency, low pollution, environmentally friendly CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2009-11-10 US disclosed
US-20060069169-A1 Use of ionic liquids as coordination ligands for organometallic catalysts CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2006-03-30 US disclosed
WO-2006033990-A2 USE OF IONIC LIQUIDS AS COORDINATION LIGANDS FOR ORGANOMETALLIC CATALYSTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2006-03-30 WO disclosed