Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL28293295

CCCCc1cccc(CCCC)c1O.CCCCc1cccc(CCCC)c1O.S

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.59
PTGS2 P35354 1/20 0.59
GABRA1 P14867 2/20 0.56
GABRB2 P47870 2/20 0.56
IAPP P10997 2/20 0.51
ELANE P08246 3/20 0.49
CTSG P08311 3/20 0.49
TYR P14679 2/20 0.48
BID P55957 3/20 0.47
MCL1 Q07820 3/20 0.47
BCL2L1 Q07817 2/20 0.47
BAK1 Q16611 2/20 0.47
KAT8 Q9H7Z6 2/20 0.47
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
EP300 Q09472 1/20 0.47
KAT2A Q92830 1/20 0.47
KAT2B Q92831 1/20 0.47
KAT5 Q92993 1/20 0.47
SAE1 Q9UBE0 1/20 0.47

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
SCHEMBL201764 0.98 ALOX5 (0.61) ALOX5PTGS2GABRA1GABRB2IAPP
SCHEMBL1024684 0.93 ALOX5 (0.58) ALOX5PTGS2GABRA1GABRB2IAPP
SCHEMBL1023094 0.91 GABRA1 (0.71) ALOX5PTGS2GABRA1GABRB2IAPP
SCHEMBL27985283 0.91 ALOX5 (0.66) ALOX5PTGS2GABRA1GABRB2ELANE
SCHEMBL8448603 0.91 ALOX5 (0.66) ALOX5PTGS2GABRA1GABRB2ELANE
SCHEMBL10475391 0.91 ALOX5 (0.56) ALOX5PTGS2GABRA1GABRB2IAPP
SCHEMBL2355153 0.91 ALOX5 (0.70) ALOX5PTGS2GABRA1GABRB2IAPP
SCHEMBL4959229 0.89 ALOX5 (0.68) ALOX5PTGS2GABRA1GABRB2ELANE
SCHEMBL10926251 0.89 ALOX5 (0.68) ALOX5PTGS2GABRA1GABRB2ELANE
SCHEMBL4962037 0.89 ALOX5 (0.68) ALOX5PTGS2GABRA1GABRB2ELANE

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-106565567-B A kind of regeneration method of highly efficient regeneration auxiliary agent, preparation method and useless butyl inner tube 青岛科技大学 2019-04-09 CN claimed