Sulfuric Acid

Sulfuric Acid

SCHEMBL9681916

COCCNc1ccc(N)cc1Cl.COCCNc1ccc(N)cc1Cl.O.O=S(=O)(O)O.O=S(=O)(O)O

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

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
PTGER4 P35408 3/20 0.49
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
CYP3A4 P08684 1/20 0.47
THRB P10828 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
CASP1 P29466 1/20 0.47
RECQL P46063 1/20 0.47
MAPT P10636 3/20 0.41
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA3 P07451 2/20 0.40
CA6 P23280 2/20 0.40
CA5A P35218 2/20 0.40
CA7 P43166 2/20 0.40
CA9 Q16790 2/20 0.40
CA13 Q8N1Q1 2/20 0.40

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
SCHEMBL9499759 0.90 PTGER4 (0.50) PTGER4ALDH1A1HPGDHSD17B10CYP3A4
Hydrochloric Acid SCHEMBL9681918 0.88 PTGER4 (0.49) PTGER4ALDH1A1HPGDHSD17B10CYP3A4
Sulfuric Acid SCHEMBL9682447 0.83 PTGER4 (0.49) PTGER4ALDH1A1HPGDHSD17B10TSHR
Sulfuric Acid SCHEMBL11325766 0.81 ALDH1A1 (0.54) ALDH1A1HPGDHSD17B10CYP3A4THRB
Sulfuric Acid SCHEMBL10825924 0.79 ALDH1A1 (0.56) ALDH1A1HPGDHSD17B10CYP3A4THRB
SCHEMBL17538568 0.76 CYP3A4 (0.43) ALDH1A1HPGDHSD17B10CYP3A4THRB
SCHEMBL25314972 0.74 PTGER4 (0.70) PTGER4ALDH1A1HPGDTHRBTSHR
SCHEMBL25314456 0.74 PTGER4 (0.56) PTGER4ALDH1A1HPGDHSD17B10TSHR
SCHEMBL11311817 0.74 PTGER4 (0.50) PTGER4ALDH1A1MAPTLMNAHCAR3
Sulfuric Acid SCHEMBL11089366 0.74 ALDH1A1 (0.61) ALDH1A1HPGDHSD17B10CYP3A4THRB

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
US-5167669-A Hair dyes L'OREAL (FR) 1992-12-01 US disclosed
US-5096455-A PROCESS FOR DYEING KERATINOUS FIBRES EMPLOYING AN INDOLE DYE AND AT LEAST ONE PARA-PHENYLENEDIAMINE CONTAINING A SECONDARY AMINO GROUP ABSENT AN OXIDANT OTHER THAN AIR L'OREAL (FR) 1992-03-17 US disclosed