Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL28795253

Cc1ccccc1OS(=O)(=O)C(F)(F)F.S

nearest known ligand 0.41

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.41
DRD3 P35462 6/20 0.41
DRD4 P21917 4/20 0.41
DRD1 P21728 2/20 0.41
DRD5 P21918 2/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ESR1 P03372 1/20 0.39
GAA P10253 1/20 0.39
ESR2 Q92731 1/20 0.39
HTR1D P28221 2/20 0.38
HTR5A P47898 1/20 0.37
HPGD P15428 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 1/20 0.36
TSHR P16473 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
SCHEMBL2984151 0.98 DRD2 (0.42) DRD2DRD3DRD4DRD1DRD5
SCHEMBL30665126 0.98 DRD2 (0.42) DRD2DRD3DRD4DRD1DRD5
Biphenyl SCHEMBL4350539 0.95 DRD2 (0.39) DRD2DRD3DRD4DRD1DRD5
SCHEMBL23301867 0.86 DRD2 (0.40) DRD2DRD3DRD4DRD1DRD5
Hydrogen Sulfide SCHEMBL27838727 0.86 MAPT (0.42) DRD2DRD3DRD4DRD1DRD5
SCHEMBL3240871 0.84 DRD2 (0.36) DRD2DRD3DRD4DRD1DRD5
SCHEMBL1712875 0.84 DRD2 (0.43) DRD2DRD3DRD4DRD1DRD5
SCHEMBL6934553 0.84 MAPT (0.43) DRD2DRD3DRD4DRD1DRD5
SCHEMBL10029309 0.82 DRD2 (0.41) DRD2DRD3DRD4DRD1DRD5
SCHEMBL19948194 0.81 DRD2 (0.41) DRD2DRD3DRD4DRD1DRD5

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
CN-102186812-A Methods for preparing fluoroalkyl arylsulfinyl compounds and fluorinated compounds thereto UBE INDUSTRIES 2011-09-14 CN disclosed