SCHEMBL28929068

SCHEMBL28929068

CCCCCCCCCCCCCCCCC(CCS)C(=O)[O-].CCCCCCCCCCCCCCCCC(CCS)C(=O)[O-].CCCCCCCCCCCCCCCCC(CCS)C(=O)[O-].[Sb+3]

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.72
NFKB1 P19838 3/20 0.52
CYP3A4 P08684 2/20 0.52
TSHR P16473 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
CA1 P00915 2/20 0.50
GPR84 Q9NQS5 7/20 0.43
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
FFAR1 O14842 1/20 0.41
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40

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
SCHEMBL28000856 1.00 CA2 (0.72) CA2NFKB1CYP3A4TSHRNPSR1
SCHEMBL11309621 1.00 CA2 (0.72) CA2NFKB1CYP3A4TSHRNPSR1
SCHEMBL11305869 0.96 CA2 (0.72) CA2NFKB1CYP3A4TSHRNPSR1
SCHEMBL11118882 0.96 CA2 (0.72) CA2NFKB1CYP3A4TSHRNPSR1
SCHEMBL11119762 0.96 CA2 (0.72) CA2NFKB1CYP3A4TSHRNPSR1
Zinc Ion SCHEMBL6051381 0.96 CA2 (0.72) CA2NFKB1CYP3A4TSHRNPSR1
SCHEMBL11665960 0.95 CA2 (0.70) CA2NFKB1CYP3A4TSHRNPSR1
SCHEMBL11599345 0.95 CA2 (0.70) CA2NFKB1CYP3A4TSHRNPSR1
SCHEMBL10741536 0.95 CA2 (0.70) CA2NFKB1CYP3A4TSHRNPSR1
SCHEMBL33524979 0.95 CA2 (0.70) CA2NFKB1CYP3A4TSHRNPSR1

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-115584159-A Ultraviolet-curing silk-screen fission ink and preparation method thereof 武汉红金龙印务股份有限公司 2023-01-10 CN disclosed