Sulfuric Acid

Sulfuric Acid

SCHEMBL11380811

O=S(=O)([O-])[O-].OCC(O)C[n+]1ccccc1.[H+]

nearest known ligand 0.41

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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 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CHRNA7 P36544 1/20 0.40
TP53 P04637 1/20 0.37
GGPS1 O95749 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MMP1 P03956 1/20 0.31
MMP7 P09237 1/20 0.31
MMP8 P22894 1/20 0.31
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31
GLA P06280 1/20 0.31

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 SCHEMBL11331738 0.98 CYP1A2 (0.42) CYP1A2CYP2D6CHRNA7TP53GGPS1
Sulfuric Acid SCHEMBL11331697 0.93 CYP1A2 (0.41) CYP1A2CYP2D6CHRNA7TP53GGPS1
Sulfuric Acid SCHEMBL11383711 0.91 CHRNA7 (0.41) CYP1A2CYP2D6CHRNA7
Sulfuric Acid SCHEMBL11346791 0.89 CHRNA7 (0.42) CYP1A2CYP2D6CHRNA7GGPS1
SCHEMBL4133422 0.86 CHRNA7 (0.48) CYP1A2CYP2D6CHRNA7
Hydrochloric Acid SCHEMBL9013751 0.84 CHRNA7 (0.47) CYP1A2CYP2D6CHRNA7
SCHEMBL29558436 0.79 CHRNA7 (0.41) CYP1A2CYP2D6CHRNA7GGPS1KDM4E
SCHEMBL9074655 0.79 CHRNA7 (0.41) CYP1A2CYP2D6CHRNA7GGPS1KDM4E
Sulfuric Acid SCHEMBL11346711 0.77 KDM4E (0.37) CYP1A2CYP2D6TP53GGPS1KDM4E
SCHEMBL16673968 0.75 CHRNA7 (0.53) CYP1A2CYP2D6CHRNA7

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
EP-0008447-B1 N-(2,3-DIHYDROXYPROPYL)-PYRIDINIUM SULFATES, THEIR PREPARATION AND GALVANIC-ACID NICKEL BATHS CONTAINING THEM Henkel Kommanditgesellschaft auf Aktien (DE) 1981-10-21 EP claimed
US-4270987-A AS LEVELING AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1981-06-02 US claimed