Zinc Ion

Zinc Ion

SCHEMBL6690144

CCCCCCCCCCCCCCCCCCSCCC(=O)[O-].CCCCCCCCCCCCCCCCCCSCCC(=O)[O-].[Zn+2]

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.52
GMNN O75496 1/20 0.52
TP53 P04637 1/20 0.52
POLB P06746 1/20 0.52
MAPT P10636 1/20 0.52
THRB P10828 1/20 0.52
CYP2C9 P11712 1/20 0.52
BLM P54132 1/20 0.52
HSD17B10 Q99714 1/20 0.52
CA1 P00915 1/20 0.50
FABP3 P05413 5/20 0.48
CES1 P23141 7/20 0.46
FAAH O00519 4/20 0.46
PLA2G6 O60733 1/20 0.46
GPR84 Q9NQS5 1/20 0.46

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
Zinc Ion SCHEMBL3296098 1.00 CES2 (0.52) CES2GMNNTP53POLBMAPT
SCHEMBL10627590 0.96 CA1 (0.56) CES2GMNNTP53POLBMAPT
Lithium Ion SCHEMBL8536238 0.96 CES2 (0.52) CES2GMNNTP53POLBMAPT
Succinic Acid SCHEMBL28071348 0.90 CA1 (0.58) CES2GMNNTP53POLBMAPT
Dioctylsulfane SCHEMBL27376717 0.90 CA1 (0.58) CES2GMNNTP53POLBMAPT
E388 SCHEMBL2936715 0.85 CA1 (0.47) CES2CA1FABP3CES1GPR84
E388 SCHEMBL20262040 0.83 CA1 (0.45) CES2CA1FABP3CES1GPR84
Tetradecylthioacetic Acid SCHEMBL7109997 0.82 CES2 (0.64) CES2GMNNTP53POLBMAPT
Zinc Ion SCHEMBL967146 0.82 CES2 (0.64) CES2GMNNTP53POLBMAPT
Zinc Ion SCHEMBL964229 0.82 CES2 (0.64) CES2GMNNTP53POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0987295-B1 Combination of an organothio compound and a zinc mercapto ester as heat stabilizer in PVC processing MORTON INT INC (US) 2004-07-21 EP disclosed
US-6462116-B2 POLYVINYL CHLORIDE(PVC), OR OTHER HALOPOLYMERS; 2-MERCAPTOETHANOL AND ZINC BIS(2-ETHYLHEXYLTHIOGLYCOLATE) FOR EXAMPLE; ELIMINATES ZINC BURN DURING PROCESSING MORTON INTERNATIONAL, INC. 2002-10-08 US disclosed
US-20010036987-A1 Combination of an organothio compound and a zinc mercapto ester as a heat stabilizer in PVC processing MORTON INTERNATIONAL, INC. 2001-11-01 US disclosed
EP-0987295-A1 Combination of an organothio compound and a zinc mercapto ester as heat stabilizer in PVC processing MORTON INTERNATIONAL, INC. (US) 2000-03-22 EP disclosed