Sulfuric Acid

Sulfuric Acid

SCHEMBL11247716

CCOC(=O)c1cnc2c(OC)cccc2c1Nc1ccccc1CC.O=S(=O)(O)O

nearest known ligand 0.77

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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 8)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 1/20 0.60
ATP4B P51164 1/20 0.60
MAPT P10636 2/20 0.58
TP53 P04637 1/20 0.58
MEN1 O00255 1/20 0.58
ALDH1A1 P00352 1/20 0.58
LMNA P02545 1/20 0.58
KMT2A Q03164 1/20 0.58

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
SCHEMBL11241711 0.96 ATP4A (0.64) ATP4AATP4BMAPTTP53
Phosphoric Acid SCHEMBL11239057 0.93 ATP4A (0.60) ATP4AATP4BMAPTTP53
Sulfuric Acid SCHEMBL11232152 0.91 ATP4A (0.72) ATP4AATP4B
SCHEMBL11245876 0.89 ATP4A (0.68) ATP4AATP4BMAPTTP53MEN1
Hydrochloric Acid SCHEMBL11235097 0.88 ATP4A (0.67) ATP4AATP4BMAPTTP53MEN1
SCHEMBL7847409 0.87 ATP4A (0.78) ATP4AATP4B
SCHEMBL11244936 0.87 THRB (0.70) ATP4AATP4BMAPTTP53MEN1
Hydrochloric Acid SCHEMBL11233513 0.86 THRB (0.69) ATP4AATP4BMAPTTP53MEN1
Hydrochloric Acid SCHEMBL11233459 0.86 ATP4A (0.76) ATP4AATP4B
SCHEMBL23494100 0.85 ATP4A (0.63) ATP4AATP4BMAPTMEN1ALDH1A1

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
US-4343804-A 4-Amino-3-quinolinecarboxylic acids and esters-antisecretory anti-ulcer compounds A. H. ROBINS COMPANY, INC. (US) 1982-08-10 US disclosed