Zinc Ion

Zinc Ion

SCHEMBL9500780

CC(C)CCCc1cc(C(C)(C)C)cc(C(=O)[O-])c1O.CC(C)CCCc1cc(C(C)(C)C)cc(C(=O)[O-])c1O.[Zn+2]

nearest known ligand 0.35

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.35
NR5A2 O00482 1/20 0.34
NR5A1 Q13285 1/20 0.34
GPR84 Q9NQS5 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
HIF1A Q16665 1/20 0.31
ALOX5 P09917 2/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
F10 P00742 1/20 0.31
PRSS1 P07477 1/20 0.31
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 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
Zinc Ion SCHEMBL8461982 0.95 CYP2C19 (0.33) CYP2C19NR5A2NR5A1CYP1A2CYP2D6
Zinc Ion SCHEMBL8464744 0.95 CYP2C19 (0.33) CYP2C19NR5A2NR5A1CYP1A2CYP2D6
SCHEMBL8462353 0.92 FUT7 (0.34) CYP2C19NR5A2NR5A1CYP1A2CYP2D6
SCHEMBL8461746 0.92 FUT7 (0.34) CYP2C19NR5A2NR5A1CYP1A2CYP2D6
Potassium Ion SCHEMBL8463801 0.92 CYP2C19 (0.33) CYP2C19NR5A2NR5A1CYP1A2CYP2D6
Potassium Ion SCHEMBL8461114 0.92 CYP2C19 (0.33) CYP2C19NR5A2NR5A1CYP1A2CYP2D6
SCHEMBL9502083 0.86 AKR1C2 (0.38) CYP2C19NR5A2NR5A1GPR84GRIN2D
Zinc Ion SCHEMBL8465269 0.84 FUT7 (0.30)
Zinc Ion SCHEMBL8465162 0.83 CYP3A4 (0.33) CYP2D6CYP2C9HIF1A
Zinc Ion SCHEMBL9700895 0.82 ALOX5 (0.43) GPR84GRIN2DGRIN2AGRIN2BGRIN2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0318941-B1 DEVELOPER FOR PRESSURE-SENSITIVE RECORDING SHEETS, AQUEOUS DISPERSION OF THE DEVELOPER AND METHOD FOR PREPARING THE DEVELOPER Sanko Kaihatsu Kagaku Kenkyusho (JP) 1993-06-09 EP disclosed
US-5118443-A DEVELOPER FOR PRESSURE-SENSITIVE RECORDING SHEETS, AQUEOUS DISPERSION OF THE DEVELOPER AND METHOD FOR PREPARING THE DEVELOPER SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1992-06-02 US disclosed
EP-0318941-A2 Developer for pressure-sensitive recording sheets, aqueous dispersion of the developer and method for preparing the developer Sanko Kaihatsu Kagaku Kenkyusho (JP) 1989-06-07 EP disclosed