Sulfuric Acid

Sulfuric Acid

SCHEMBL1764302

CSCC[C@H](N)C(=O)OC(=O)CN.O=S(=O)(O)O.[Zn].[Zn]

nearest known ligand 0.46

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 12)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 6/20 0.33
METAP2 P50579 1/20 0.33
METAP1 P53582 1/20 0.33
CASP1 P29466 1/20 0.32
RNPEP Q9H4A4 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
LMNA P02545 1/20 0.30
ANPEP P15144 1/20 0.30
ENPEP Q07075 1/20 0.30

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
SCHEMBL2319973 0.92 METAP2 (0.36) MARS1METAP2METAP1RNPEPANPEP
Serine SCHEMBL5577056 0.82 RNPEP (0.37) MARS1METAP2METAP1RNPEP
SCHEMBL11751540 0.82 METAP2 (0.39) MARS1METAP2METAP1RNPEPANPEP
SCHEMBL16513337 0.80 METAP2 (0.40) MARS1METAP2METAP1RNPEPANPEP
SCHEMBL6550850 0.80 RNPEP (0.37) MARS1METAP2METAP1RNPEPANPEP
SCHEMBL542056 0.80 RNPEP (0.37) MARS1METAP2METAP1RNPEPANPEP
SCHEMBL11750431 0.80 RNPEP (0.37) MARS1METAP2METAP1RNPEPANPEP
Threonine SCHEMBL6367180 0.80 METAP2 (0.35) MARS1METAP2METAP1RNPEP
SCHEMBL162031 0.80 RNPEP (0.42) MARS1METAP2METAP1RNPEPANPEP
SCHEMBL6045793 0.80 RNPEP (0.42) MARS1METAP2METAP1RNPEPANPEP

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
US-20110117210-A1 Therapeutic treatment of human cancers using simple salts of zinc UGOLKOV ANDREY 2011-05-19 US claimed