Sulfuric Acid

Sulfuric Acid

SCHEMBL4458775

C=CC(=O)Nc1ncnc(NC(=O)C=C)c1NC(=O)C=C.C=CC(=O)Nc1ncnc(NC(=O)C=C)c1NC(=O)C=C.C=CC(=O)Nc1ncnc(NC(=O)C=C)c1NC(=O)C=C.C=CC(=O)Nc1ncnc(NC(=O)C=C)c1NC(=O)C=C.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O

nearest known ligand 0.41

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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 12)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 10/20 0.41
▸ FYN P06241 7/20 0.40
▸ SRC P12931 7/20 0.40
▸ TGM2 P21980 2/20 0.39
▸ VCP P55072 3/20 0.39
▸ PSMC4 P43686 1/20 0.39
▸ ERBB2 P04626 1/20 0.36
▸ BLK P51451 1/20 0.36
▸ BMX P51813 1/20 0.36
▸ JAK3 P52333 1/20 0.36
▸ BTK Q06187 1/20 0.36
▸ ERBB4 Q15303 1/20 0.36

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 SCHEMBL5537630 0.85 MAPK3 (0.37) EGFRTGM2
Sulfuric Acid SCHEMBL5242393 0.81 TGM2 (0.37) EGFRTGM2BTK
Pyrimidine SCHEMBL4456823 0.77 BTK (0.36) EGFRFYNSRCTGM2JAK3
Sulfuric Acid SCHEMBL4461982 0.75 MAPK3 (0.36) EGFR
SCHEMBL22287107 0.72 TGM2 (0.39) EGFRTGM2
Sulfuric Acid SCHEMBL5243123 0.71 NPC1 (0.44) EGFRTGM2
Sulfuric Acid SCHEMBL5244029 0.71 MAPK3 (0.41) EGFRTGM2
SCHEMBL67930 0.69 JAK3 (0.39) EGFRFYNSRCTGM2VCP
SCHEMBL1398283 0.68 BRD4 (0.58) —
Sulfuric Acid SCHEMBL10783007 0.66 TGM2 (0.85) EGFRTGM2

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-7560522-B2 Inclusion complexes of unsaturated monomers, their polymers and process for preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2009-07-14 — — US disclosed
US-20070213489-A1 Inclusion complexes of unsaturated monomers, their polymers and process for preparation thereof PATIL PRERANA M 2007-09-13 — — US disclosed
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