Sulfuric Acid

Sulfuric Acid

SCHEMBL4461982

C=C(C)C(=O)Nc1ncnc(NC(=O)C(=C)C)c1NC(=O)C(=C)C.C=CC(=O)Nc1ncc(NC(=O)C=C)c(NC(=O)C=C)n1.O=S(=O)(O)O.O=S(=O)(O)O

nearest known ligand 0.36

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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 7)

geneUniProtsupporting neighboursconfidence
▸ MAP2K1 known ✓ Q02750 1/20 0.32
▸ MAPK3 P27361 15/20 0.36
▸ FGFR4 P22455 2/20 0.35
▸ MAPK1 P28482 3/20 0.34
▸ EGFR P00533 3/20 0.33
▸ KDR P35968 1/20 0.33
▸ ITK Q08881 1/20 0.33

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 0.89 MAPK3 (0.37) MAPK3FGFR4MAPK1EGFRITK
Sulfuric Acid SCHEMBL5244029 0.83 MAPK3 (0.41) MAPK3MAPK1EGFRITKMAP2K1
Sulfuric Acid SCHEMBL5425255 0.80 TGM2 (0.35) —
Sulfuric Acid SCHEMBL4456717 0.79 JAK3 (0.33) MAPK3FGFR4MAPK1EGFR
Sulfuric Acid SCHEMBL4458775 0.75 EGFR (0.41) EGFR
Sulfuric Acid SCHEMBL5242393 0.68 TGM2 (0.37) EGFRITK
Pyrimidine SCHEMBL4456823 0.65 BTK (0.36) EGFRITK
Sulfuric Acid SCHEMBL5243123 0.61 NPC1 (0.44) EGFRITK
Sulfuric Acid SCHEMBL5242033 0.60 HTT (0.49) MAPK1
Methylamine SCHEMBL27678870 0.58 TGM2 (0.42) MAPK3EGFRITK

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 6 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-20070265365-A1 Water Soluble Polymers Containing Vinyl Unsaturation, Their Crosslinking and Process for Preparation Thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-11-15 — — US disclosed
US-20070213486-A1 Inclusion complexes of unsaturated monomers, their polymers and process for preparation thereof PATIL PRERANA M 2007-09-13 — — 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
US-20070213470-A1 Inclusion complexes of unsaturated monomers, their polymers and process for preparation thereof PATIL PRERANA M 2007-09-13 — — US disclosed
US-20060094844-A1 Inclusion complexes of unsaturated monomers, their polymers and process for preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH 2006-05-04 — — US disclosed
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