SCHEMBL28984792

SCHEMBL28984792

N[C@@H](CS)C(=O)OC([SeH])[SeH]

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.46
SLC7A11 Q9UPY5 1/20 0.46
ENPEP Q07075 4/20 0.32
ANPEP P15144 2/20 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
SCHEMBL9384783 0.79 PTGS1 (0.48) PTGS1SLC7A11ENPEPANPEP
SCHEMBL4122570 0.77 PTGS1 (0.46) PTGS1SLC7A11ENPEPANPEP
SCHEMBL4122573 0.77 PTGS1 (0.46) PTGS1SLC7A11ENPEPANPEP
SCHEMBL7795644 0.76
Hydrochloric Acid SCHEMBL9589944 0.76 PTGS1 (0.44) PTGS1SLC7A11ENPEPANPEP
SCHEMBL4872186 0.76 PTGS1 (0.44) PTGS1SLC7A11ENPEPANPEP
SCHEMBL3396294 0.76 PTGS1 (0.44) PTGS1SLC7A11ENPEPANPEP
Hydrochloric Acid SCHEMBL8596085 0.76 PTGS1 (0.44) PTGS1SLC7A11ENPEPANPEP
SCHEMBL1964879 0.75 PTGS1 (0.55) PTGS1SLC7A11ENPEPANPEP
SCHEMBL20657045 0.75 PTGS1 (0.55) PTGS1SLC7A11ENPEPANPEP

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-114805155-A Method for preparing L-selenium methyl selenocysteine by using selenium simple substance as selenium source 河南希百康健康产业有限公司 2022-07-29 CN disclosed