Sulfuric Acid

Sulfuric Acid

SCHEMBL8915840

CCCCCCCCCCCCC(C)(N)C(C)C.CCCCCCCCCCCCC(C)(N)C(C)C.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 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.48
FDPS P14324 10/20 0.43
SMPD1 P17405 4/20 0.43
S1PR1 P21453 1/20 0.38
CA2 P00918 1/20 0.38
GGPS1 O95749 6/20 0.37
CES2 O00748 1/20 0.35
LPAR1 Q92633 1/20 0.35
LPAR3 Q9UBY5 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
SCHEMBL21599243 0.88 SMPD1 (0.42) FDPSSMPD1GGPS1
SCHEMBL4267627 0.88 SMPD1 (0.42) FDPSSMPD1GGPS1
SCHEMBL8368936 0.86 FDPS (0.40) FDPSSMPD1GGPS1
Sulfuric Acid SCHEMBL9493020 0.80 SMPD1 (0.48) TP53FDPSSMPD1CA2GGPS1
Sulfuric Acid SCHEMBL9443895 0.80 SMPD1 (0.48) TP53FDPSSMPD1CA2GGPS1
Sulfuric Acid SCHEMBL25198201 0.80 SMPD1 (0.48) TP53FDPSSMPD1CA2GGPS1
Sulfuric Acid SCHEMBL25184770 0.80 SMPD1 (0.48) TP53FDPSSMPD1CA2GGPS1
Sulfuric Acid SCHEMBL9443894 0.80 SMPD1 (0.48) TP53FDPSSMPD1CA2GGPS1
SCHEMBL8367785 0.80 FDPS (0.38) FDPSSMPD1
Sulfuric Acid SCHEMBL1095215 0.78 FDPS (0.50) TP53FDPSSMPD1CA2GGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9171090-A None JP disclosed
JP-H09171090-A MANUFACTURE OF NUCLEAR FUEL PELLET COMPOSED MAINLY OF MIXED OXIDE OF URANIUM AND PLUTONIUM AND CONTAINING ORGANIC SULFUR COMPOUND AS ADDITIVE COMMISS ENERG ATOM 1997-06-30 JP disclosed