Sulfuric Acid

Sulfuric Acid

SCHEMBL28293640

O=S(=O)(O)O.c1ccc(Cc2ccccn2)cc1

nearest known ligand 0.56

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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 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.56
TDP1 Q9NUW8 2/20 0.54
LMNA P02545 1/20 0.54
POLB P06746 1/20 0.49
KMT2A Q03164 1/20 0.47
CXCR3 P49682 1/20 0.47
CYP1A2 P05177 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP2D6 P10635 1/20 0.47
MAPT P10636 1/20 0.47
TSHR P16473 1/20 0.47
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
CYP3A4 P08684 1/20 0.46
PTPRA P18433 1/20 0.46

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
Trifluoromethanesulfonic Acid SCHEMBL28196672 0.89 L3MBTL1 (0.49) L3MBTL1TDP1LMNAPOLBKMT2A
SCHEMBL64435 0.88 L3MBTL1 (0.68) L3MBTL1TDP1LMNAPOLBCYP1A2
SCHEMBL29373231 0.88 L3MBTL1 (0.68) L3MBTL1TDP1LMNAPOLBCYP1A2
Hydrochloric Acid SCHEMBL7252291 0.86 L3MBTL1 (0.71) L3MBTL1LMNAPOLBCYP1A2CYP2D6
SCHEMBL31276017 0.86 L3MBTL1 (0.66) L3MBTL1LMNAPOLBCYP1A2CYP2D6
SCHEMBL30021715 0.86 L3MBTL1 (0.66) L3MBTL1TDP1LMNAPOLBCYP1A2
SCHEMBL29985764 0.86 L3MBTL1 (0.66) L3MBTL1TDP1LMNAPOLBCYP1A2
Hydrochloric Acid SCHEMBL31087535 0.86 L3MBTL1 (0.71) L3MBTL1LMNAPOLBCYP1A2CYP2D6
Bromide SCHEMBL10759788 0.86 L3MBTL1 (0.66) L3MBTL1TDP1LMNAPOLBCYP1A2
SCHEMBL31236458 0.86 L3MBTL1 (0.66) L3MBTL1TDP1LMNAPOLBCYP1A2

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
CN-109651238-A A kind of new method preparing picosulfate sodium 杭州新博思生物医药有限公司 2019-04-19 CN disclosed