Sulfuric Acid

Sulfuric Acid

SCHEMBL6478256

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

nearest known ligand 0.44

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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 16)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.44
▸ DNM1 Q05193 2/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HTT P42858 2/20 0.41
▸ TSHR P16473 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ ALOX5 P09917 1/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.35
▸ AKR1B10 O60218 1/20 0.35
▸ AKR1B1 P15121 1/20 0.35

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 SCHEMBL28988173 0.96 DNM1 (0.45) THRBDNM1MEN1KMT2ATP53
SCHEMBL14409026 0.94 THRB (0.49) THRBDNM1MEN1KMT2ATP53
Sulfuric Acid SCHEMBL2793229 0.93 THRB (0.46) THRBDNM1MEN1KMT2ATP53
Bromide SCHEMBL28532164 0.92 DNM1 (0.49) THRBDNM1MEN1KMT2ATP53
Hydrochloric Acid SCHEMBL3910414 0.92 TP53 (0.49) THRBDNM1MEN1KMT2ATP53
Iodide SCHEMBL28537835 0.92 THRB (0.48) THRBDNM1MEN1KMT2ATP53
Fluoride Ion SCHEMBL28525852 0.92 THRB (0.48) THRBDNM1MEN1KMT2ATP53
SCHEMBL28988183 0.91 DNM1 (0.42) THRBDNM1MEN1KMT2ATP53
Sulfuric Acid SCHEMBL28988171 0.90 DNM1 (0.46) THRBDNM1MEN1KMT2ATP53
Sulfuric Acid SCHEMBL2976040 0.89 THRB (0.45) THRBDNM1MEN1KMT2ATP53

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
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