Zinc Ion

Zinc Ion

SCHEMBL8355476

CCC(CC)NC([O-])=S.NC([O-])=S.[Zn+2]

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP8 P22894 1/20 0.35
LMNA P02545 2/20 0.31
CNR1 P21554 1/20 0.31
ADRA1A P35348 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
PTPN7 P35236 1/20 0.31
DUSP3 P51452 1/20 0.31
ABCC3 O15438 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL16628413 0.95 CA12 (0.35) CA12CA1CA2CA9MMP1
SCHEMBL4614526 0.95 CA12 (0.35) CA12CA1CA2CA9MMP1
SCHEMBL16628445 0.95 CA12 (0.35) CA12CA1CA2CA9MMP1
SCHEMBL3898778 0.83 TAS1R3 (0.35)
Zinc Ion SCHEMBL10339254 0.82 CA12 (0.48) CA12CA1CA2CA9MMP1
SCHEMBL3898502 0.80 CA2 (0.37) CA1CA2LMNATDP1
SCHEMBL3897686 0.78 CA1 (0.36) CA1CA2LMNATDP1
SCHEMBL16628523 0.77 CA12 (0.48) CA12CA1CA2CA9MMP1
SCHEMBL16628419 0.77 CA12 (0.48) CA12CA1CA2CA9MMP1
SCHEMBL3906390 0.77 TAS1R3 (0.36)

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
JP-11228790-A None JP disclosed
JP-H11228790-A SEALING RESIN COMPOSITION AND SEMICONDUCTOR SEALING DEVICE TOSHIBA CHEM CORP 1999-08-24 JP disclosed