Sulfuric Acid

Sulfuric Acid

SCHEMBL9227635

N[C@@H](CS)C(=O)Oc1ccccc1.O=S(=O)(O)O

nearest known ligand 0.41

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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 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MMP2 P08253 2/20 0.39
SLC1A3 P43003 1/20 0.39
PTGS1 P23219 2/20 0.38
SLC7A11 Q9UPY5 1/20 0.38
ELANE P08246 1/20 0.37
TMPRSS15 P98073 1/20 0.37
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
ALPI P09923 1/20 0.36
PKM P14618 1/20 0.36
XIAP P98170 1/20 0.36
SLC7A5 Q01650 1/20 0.36
LTA4H P09960 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KYNU Q16719 2/20 0.36
MMP3 P08254 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
SCHEMBL14227030 0.93 ATM (0.45) ATML3MBTL1MMP2SLC1A3PTGS1
SCHEMBL5803094 0.93 ATM (0.45) ATML3MBTL1MMP2SLC1A3PTGS1
SCHEMBL17104812 0.93 ATM (0.45) ATML3MBTL1MMP2SLC1A3PTGS1
Sulfuric Acid SCHEMBL11049283 0.83 L3MBTL1 (0.40) ATML3MBTL1SLC1A3PTGS1ELANE
Sulfuric Acid SCHEMBL11047947 0.80 KMT2A (0.43) ATML3MBTL1MMP2SLC1A3TMPRSS15
SCHEMBL24530374 0.78 ATM (0.46) ATML3MBTL1SLC1A3PTGS1ELANE
SCHEMBL27551102 0.78 ATM (0.46) ATML3MBTL1SLC1A3PTGS1ELANE
SCHEMBL2564139 0.78 ATM (0.46) ATML3MBTL1SLC1A3PTGS1ELANE
SCHEMBL16086931 0.78 ATM (0.46) ATML3MBTL1SLC1A3PTGS1ELANE
SCHEMBL27639690 0.78 ATM (0.46) ATML3MBTL1SLC1A3PTGS1ELANE

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-5446019-A Insecticidal protein ZENECA LIMITED (GB) 1995-08-29 US disclosed