Sulfuric Acid

Sulfuric Acid

SCHEMBL28313783

O=C(O)CCc1ncc[nH]1.O=S(=O)(O)O

nearest known ligand 0.86

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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 18)

geneUniProtsupporting neighboursconfidence
CHRM1 known ✓ P11229 1/20 0.41
TBXAS1 P24557 2/20 0.66
TERT O14746 1/20 0.41
TAAR1 Q96RJ0 3/20 0.40
FDPS P14324 1/20 0.39
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
APEX1 P27695 1/20 0.37
ALOX15 P16050 1/20 0.37
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
PRKAG1 P54619 1/20 0.36
PRKAA2 P54646 1/20 0.36
PRKAA1 Q13131 1/20 0.36
PRKAB1 Q9Y478 1/20 0.36
PARP1 P09874 1/20 0.36
PARP2 Q9UGN5 1/20 0.36
FPR2 P25090 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
SCHEMBL30620153 0.93 TBXAS1 (0.74) TBXAS1TERTCHRM1TAAR1FDPS
SCHEMBL434767 0.93 TBXAS1 (0.74) TBXAS1TERTCHRM1TAAR1FDPS
Hydrochloric Acid SCHEMBL28313785 0.91 TBXAS1 (0.72) TBXAS1TERTCHRM1TAAR1FDPS
Hydrochloric Acid SCHEMBL8937731 0.91 TBXAS1 (0.75) TBXAS1TERTCHRM1TAAR1FDPS
Hydrochloric Acid SCHEMBL11095352 0.91 TBXAS1 (0.75) TBXAS1TERTCHRM1TAAR1FDPS
Bromide SCHEMBL28875643 0.91 TBXAS1 (0.72) TBXAS1TERTCHRM1TAAR1FDPS
SCHEMBL8979265 0.82 TBXAS1 (0.87) TBXAS1TERTTAAR1FDPSGAA
SCHEMBL4655987 0.81 TBXAS1 (0.97) TBXAS1TERTTAAR1FDPS
Hydrochloric Acid SCHEMBL11657876 0.81 TBXAS1 (0.87) TBXAS1TERTTAAR1FDPSGAA
SCHEMBL11009198 0.79 TBXAS1 (1.00) TBXAS1TERT

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
CN-110041533-A A kind of method that ionic liquid ligand displacement method prepares functional metal organic framework material 福州大学 2019-07-23 CN claimed
CN-110041533-A A kind of method that ionic liquid ligand displacement method prepares functional metal organic framework material 福州大学 2019-07-23 CN disclosed