Sulfuric Acid

Sulfuric Acid

SCHEMBL9733800

N=C(N)NCCC[C@@H](C=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)CCCCNS(=O)(=O)c1cccc2cccnc12.O=S(=O)(O)O

nearest known ligand 0.43

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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 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 5/20 0.43
GAA P10253 2/20 0.39
ALDH1A1 P00352 3/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
RECQL P46063 1/20 0.39
F2 P00734 3/20 0.39
PLG P00747 3/20 0.39
F10 P00742 2/20 0.39
PRSS1 P07477 2/20 0.39
TSHR P16473 4/20 0.39
ALOX15 P16050 2/20 0.39
HPGD P15428 2/20 0.38
GFER P55789 1/20 0.37
HTR6 P50406 2/20 0.36
HTR1A P08908 1/20 0.36
HTR2A P28223 1/20 0.36
QPCT Q16769 1/20 0.36
HCRTR1 O43613 1/20 0.35
KMT2A Q03164 1/20 0.35

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
Hydrochloric Acid SCHEMBL7293117 0.88 GAA (0.42) HTR7GAAALDH1A1POLBMAPT
Sulfuric Acid SCHEMBL9733149 0.84 F2 (0.47) F2PLGF10PRSS1
Hydrochloric Acid SCHEMBL7411731 0.84 GAA (0.48) GAAMAPTF2PLGF10
Sulfuric Acid SCHEMBL9618234 0.83 CAPN1 (0.40) ALDH1A1F2PLGF10PRSS1
Sulfuric Acid SCHEMBL9733510 0.82 F2 (0.39) F2PLGF10PRSS1
SCHEMBL9733682 0.82 CAPN1 (0.40) ALDH1A1F2PLGF10PRSS1
Hydrochloric Acid SCHEMBL9733306 0.81 CAPN1 (0.40) ALDH1A1F2PLGF10PRSS1
Sulfuric Acid SCHEMBL9733221 0.81 DPP4 (0.45) F2PLGF10PRSS1
Sulfuric Acid SCHEMBL9732881 0.80 F2 (0.45) F2PLGF10PRSS1
Sulfuric Acid SCHEMBL9733269 0.80 F2 (0.40) F2PLGF10PRSS1

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