Sulfuric Acid

Sulfuric Acid

SCHEMBL9733221

N=C(N)NCCC[C@@H](C=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)CCCCNC(=O)c1ccccc1.O=S(=O)(O)O

nearest known ligand 0.45

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 13)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 2/20 0.39
OPRD1 known ✓ P41143 1/20 0.39
DPP4 P27487 4/20 0.45
F2 P00734 7/20 0.45
PLG P00747 4/20 0.45
F10 P00742 3/20 0.43
PRSS1 P07477 3/20 0.43
DPP8 Q6V1X1 2/20 0.41
DPP9 Q86TI2 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
NPFFR1 Q9GZQ6 2/20 0.39
NPFFR2 Q9Y5X5 2/20 0.39
CASP1 P29466 2/20 0.38

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 SCHEMBL9733730 0.93 DPP4 (0.47) DPP4F2PLGF10PRSS1
Sulfuric Acid SCHEMBL9732881 0.91 F2 (0.45) DPP4F2PLGF10PRSS1
Sulfuric Acid SCHEMBL9733332 0.90 F2 (0.47) DPP4F2PLGF10PRSS1
Sulfuric Acid SCHEMBL7264620 0.88 F2 (0.54) F2PLGOPRM1NPFFR1NPFFR2
Sulfuric Acid SCHEMBL9733268 0.86 PLG (0.39) F2PLGF10PRSS1OPRM1
Sulfuric Acid SCHEMBL9733269 0.85 F2 (0.40) DPP4F2PLGF10PRSS1
SCHEMBL7356276 0.85 F2 (0.57) F2PLGF10PRSS1OPRM1
SCHEMBL7356254 0.85 F2 (0.57) F2PLGF10PRSS1OPRM1
SCHEMBL27532662 0.85 F2 (0.57) F2PLGF10PRSS1OPRM1
SCHEMBL6850997 0.85 F2 (0.57) F2PLGF10PRSS1OPRM1

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-5153176-A Substituted lysine-proline-arginine peptide NITTO BOSEKI CO., LTD. (JP) 1992-10-06 US disclosed