Sulfuric Acid

Sulfuric Acid

SCHEMBL28285567

CCCCCOC(=O)c1ccccc1OC(C)N(CC)CC.O=S(=O)(O)O

nearest known ligand 0.56

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
▸ SCN1A known ✓ P35498 2/20 0.42
▸ SCN2A known ✓ Q99250 2/20 0.42
▸ SCN3A known ✓ Q9NY46 2/20 0.42
▸ CHRM2 known ✓ P08172 1/20 0.41
▸ ADRA2A known ✓ P08913 1/20 0.41
▸ OPRK1 known ✓ P41145 1/20 0.41
▸ SLC6A3 known ✓ Q01959 1/20 0.41
▸ ADRB2 known ✓ P07550 1/20 0.39
▸ ADRB1 known ✓ P08588 1/20 0.39
▸ ADRB3 known ✓ P13945 1/20 0.39
▸ TSHR P16473 5/20 0.56
▸ MAPK1 P28482 4/20 0.56
▸ CYP3A4 P08684 3/20 0.56
▸ TP53 P04637 1/20 0.56
▸ ALDH1A1 P00352 8/20 0.54
▸ LMNA P02545 4/20 0.54
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ KDM4E B2RXH2 3/20 0.49
▸ HSD17B10 Q99714 2/20 0.49

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
Hydrochloric Acid SCHEMBL28209306 0.94 TSHR (0.59) TSHRMAPK1CYP3A4TP53ALDH1A1
Acetic Acid SCHEMBL28318749 0.92 TSHR (0.57) TSHRMAPK1CYP3A4TP53ALDH1A1
Sulfuric Acid SCHEMBL27302890 0.79 ALDH1A1 (0.87) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL23332021 0.78 TSHR (0.69) TSHRMAPK1CYP3A4TP53ALDH1A1
Sulfuric Acid SCHEMBL28123758 0.77 ALDH1A1 (0.84) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL28313448 0.77 ALDH1A1 (0.68) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL3805742 0.76 TSHR (0.78) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL30173476 0.76 TSHR (0.78) TSHRMAPK1CYP3A4TP53ALDH1A1
Dibutyl Phthalate SCHEMBL28178647 0.76 TSHR (0.86) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL11349185 0.75 TSHR (0.59) TSHRMAPK1CYP3A4TP53ALDH1A1

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-104276962-B A kind of aspirin derivatives and combinations thereof and application 浙江越甲药业有限公司 2019-04-12 — — CN disclosed
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