Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL28099567

O=S(=O)(O)CC(O)CCl.O=S(=O)(O)CC(O)CCl.S

nearest known ligand 0.43

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Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 1/20 0.43
SLC22A6 Q4U2R8 1/20 0.37
GABBR2 O75899 1/20 0.31
GABBR1 Q9UBS5 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
APEX1 P27695 1/20 0.30

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
SCHEMBL20582199 0.97
SCHEMBL151184 0.97
SCHEMBL27498737 0.95 CA1 (0.43) CA1CA2CA9SLC22A6GABBR2
Ammonia Solution, Strong SCHEMBL27517712 0.95 CA1 (0.43) CA1CA2CA9SLC22A6GABBR2
SCHEMBL28040116 0.95 CA1 (0.43) CA1CA2CA9SLC22A6GABBR2
SCHEMBL23793924 0.95 CA1 (0.43) CA1CA2CA9SLC22A6GABBR2
SCHEMBL29761917 0.95 CA1 (0.43) CA1CA2CA9SLC22A6GABBR2
SCHEMBL272977 0.95 CA1 (0.43) CA1CA2CA9SLC22A6GABBR2
Water SCHEMBL4418331 0.92 CA1 (0.42) CA1CA2CA9SLC22A6
Ether SCHEMBL9859454 0.83 CA1 (0.34) CA1CA2CA9SLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106102703-A Comprise internal olefin sulphonates and the composition, foam of a kind of polymer suspending agent 莱雅公司 2016-11-09 CN claimed
CN-106102703-A Comprise internal olefin sulphonates and the composition, foam of a kind of polymer suspending agent 莱雅公司 2016-11-09 CN disclosed