Sulfuric Acid

Sulfuric Acid

SCHEMBL7959517

CCCOc1ccc(Cl)cc1-c1nc(N)c(N)c(=O)[nH]1.O=S(=O)(O)O.O=S(=O)(O)O

nearest known ligand 0.51

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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
PDE5A O76074 20/20 0.51
PDE6D O43924 1/20 0.46
PDE6A P16499 1/20 0.46
PDE6G P18545 1/20 0.46
PDE6B P35913 1/20 0.46
PDE6C P51160 1/20 0.46
PDE6H Q13956 1/20 0.46

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 SCHEMBL7965320 0.87 PDE5A (0.50) PDE5APDE6DPDE6APDE6GPDE6B
Sulfuric Acid SCHEMBL7718120 0.85 PDE5A (0.56) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL7965371 0.82 PDE5A (0.52) PDE5APDE6DPDE6APDE6GPDE6B
Sulfuric Acid SCHEMBL7961340 0.82 PDE5A (0.44) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL7965295 0.81 PDE5A (0.55) PDE5APDE6DPDE6APDE6GPDE6B
Sulfuric Acid SCHEMBL7965337 0.80 PDE5A (0.43) PDE5APDE6DPDE6APDE6GPDE6B
Sulfuric Acid SCHEMBL7960505 0.80 PDE5A (0.52) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL7029661 0.79 PDE5A (0.62) PDE5APDE6DPDE6APDE6GPDE6B
Sulfuric Acid SCHEMBL7959520 0.76 PTGER1 (0.39) PDE5A
Sulfuric Acid SCHEMBL7959122 0.76 GUSB (0.58) PDE5A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6200980-B1 ADMINISTERING PHENYL PURINONE COMPOUND FOR TREATING PRECANCEROUS LEISONS CELL PATHWAYS, INC. 2001-03-13 US disclosed
EP-0352960-B1 Purine compounds, process for their preparation and pharmaceutical compositions SMITH KLINE FRENCH LAB (GB) 1994-10-26 EP disclosed
US-5073559-A 2-Substituted purinone having phosphodiesterase inhibitory activity SMITH KLINE & FRENCH LABORATORIES, LTD. (GB) 1991-12-17 US disclosed
EP-0352960-A2 Purine compounds, process for their preparation and pharmaceutical compositions SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1990-01-31 EP disclosed