Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL28295812

C=CC(=O)NC(C)(C)CC.S

nearest known ligand 0.51

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
TSHR P16473 3/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
EPHX1 P07099 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL460924 0.98 ALDH1A1 (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL28949902 0.96 ALDH1A1 (0.51) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
Bicarbonate SCHEMBL9854206 0.94 ALDH1A1 (0.54) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
Sulfuric Acid SCHEMBL1975929 0.90 ALDH1A1 (0.47) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
Phosphoric Acid SCHEMBL22773414 0.90 ALDH1A1 (0.47) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
Phosphonic Acid SCHEMBL2560198 0.90 ALDH1A1 (0.47) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL19860763 0.82 ALDH1A1 (0.55) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL9762672 0.82 ALDH1A1 (0.47) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL4906709 0.81 KMT2A (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL903004 0.80 ALDH1A1 (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A

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-109689970-A Low molecular weight dried powder as papermaking dry strength agents 艺康美国股份有限公司 2019-04-26 CN claimed