Sulfuric Acid

Sulfuric Acid

SCHEMBL6476044

C=C(C)C(=O)NCCC[N+](C)(C)Cc1ccccc1.C=C(C)C(=O)NCCC[N+](C)(C)Cc1ccccc1.O=S(=O)([O-])[O-]

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

dacAdacBdacCftsImrcAmrcBmrdA

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 19)

geneUniProtsupporting neighboursconfidence
PLAAT5 Q96KN8 8/20 0.43
PLAAT4 Q9UL19 8/20 0.43
PLAAT3 P53816 7/20 0.43
PLAAT2 Q9NWW9 7/20 0.43
DNM1 Q05193 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 2/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
BCHE P06276 1/20 0.39
ACHE P22303 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
SCHEMBL17555032 0.94 DNM1 (0.48) PLAAT5PLAAT4PLAAT3PLAAT2DNM1
Sulfuric Acid SCHEMBL6472910 0.93 BCHE (0.46) PLAAT5PLAAT4PLAAT3PLAAT2DNM1
Bromide SCHEMBL29825165 0.92 DNM1 (0.49) PLAAT5PLAAT4PLAAT3PLAAT2DNM1
Hydrochloric Acid SCHEMBL1840256 0.92 KMT2A (0.49) PLAAT5PLAAT4PLAAT3PLAAT2DNM1
SCHEMBL18314761 0.87 BCHE (0.40) PLAAT5PLAAT4PLAAT3PLAAT2DNM1
SCHEMBL31476923 0.86 BCHE (0.51) PLAAT5PLAAT4PLAAT3PLAAT2DNM1
Hydrochloric Acid SCHEMBL4884176 0.84 BCHE (0.53) PLAAT5PLAAT4PLAAT3PLAAT2DNM1
SCHEMBL18314766 0.83 PSMD14 (0.40) PLAAT5PLAAT4PLAAT3PLAAT2DNM1
Sulfuric Acid SCHEMBL6472879 0.83 TGM2 (0.48) DNM1MEN1KMT2ASMN1; SMN2TP53
Cetalkonium SCHEMBL27745607 0.81 DNM1 (0.56) DNM1MEN1KMT2ASMN1; SMN2TP53

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
WO-2005075531-A1 AMPHIPHILIC BLOCK AND GRAFT COPOLYMERS CONTAINING HEAVY ELEMENTS, METHOD FOR THE PRODUCTION THEREOF, AND USE OF THE SAME AS X-RAY CONTRAST AGENTS FRAUNHOFER-GESELLSCHAFT ZUR FOERDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2005-08-18 WO disclosed