Sulfuric Acid

Sulfuric Acid

SCHEMBL28200091

Clc1ccc(Cl)c(Cl)c1.NN.O=S(=O)(O)O

nearest known ligand 0.64

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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
CHRM1 known ✓ P11229 1/20 0.41
SLC6A2 known ✓ P23975 1/20 0.41
ADRA1A known ✓ P35348 1/20 0.41
OPRM1 known ✓ P35372 1/20 0.41
TP53 P04637 3/20 0.64
FLT1 P17948 2/20 0.47
FLT4 P35916 2/20 0.47
KDR P35968 2/20 0.47
CYP2C9 P11712 1/20 0.47
TSHR P16473 7/20 0.45
ALDH1A1 P00352 4/20 0.45
CYP3A4 P08684 3/20 0.45
HSD17B10 Q99714 3/20 0.45
CASP1 P29466 2/20 0.45
HPGD P15428 2/20 0.45
THRB P10828 1/20 0.45
ALOX15 P16050 1/20 0.45
RECQL P46063 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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 SCHEMBL15569981 0.95 TP53 (0.70) TP53FLT1FLT4KDRCYP2C9
Sulfuric Acid SCHEMBL19739057 0.93 TP53 (0.67) TP53FLT1FLT4KDRCYP2C9
Sulfuric Acid SCHEMBL1303187 0.93 TP53 (0.67) TP53FLT1FLT4KDRCYP2C9
Hydrazine SCHEMBL28200066 0.85 TP53 (0.88) TP53TSHRALDH1A1CYP3A4HSD17B10
SCHEMBL8976280 0.83 TP53 (0.74) TP53FLT1FLT4KDRTSHR
Hydrazine SCHEMBL28200142 0.83 TP53 (0.82) TP53TSHRALDH1A1CYP3A4HSD17B10
Oxalic Acid SCHEMBL28856224 0.82 TP53 (0.64) TP53FLT1FLT4KDRTSHR
Phosphoric Acid SCHEMBL28200084 0.82 TP53 (0.64) TP53FLT1FLT4KDRTSHR
Sulfuric Acid SCHEMBL11689455 0.80 TSHR (0.74) TP53FLT1FLT4KDRCYP2C9
Sulfuric Acid SCHEMBL28119801 0.80 TSHR (0.74) TP53FLT1FLT4KDRCYP2C9

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-107663161-A A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt 上海惠和化德生物科技有限公司 2018-02-06 CN disclosed