Zinc Ion

Zinc Ion

SCHEMBL28819502

O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Zn+2].c1c[nH]nn1.c1c[nH]nn1.c1c[nH]nn1.c1c[nH]nn1.c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.34

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 1/20 0.34
▸ CES1 P23141 1/20 0.34
▸ F2 P00734 2/20 0.34
▸ PLAU P00749 2/20 0.34
▸ ELANE P08246 2/20 0.34
▸ PRMT1 Q99873 1/20 0.33
▸ KLKB1 P03952 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ MAPT P10636 2/20 0.32
▸ ESR2 Q92731 2/20 0.32
▸ CYP2C9 P11712 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ MEN1 O00255 4/20 0.31
▸ KMT2A Q03164 4/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ MITF O75030 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
Bromide SCHEMBL28825975 0.88 SNCA (0.33) F2ESR2MEN1KMT2ALMNA
SCHEMBL28061261 0.88 KMT2A (0.33) CES2CES1F2ALDH1A1ESR2
SCHEMBL27970673 0.88 KMT2A (0.33) CES2CES1F2ALDH1A1ESR2
SCHEMBL28016232 0.86 MEN1 (0.32) CES2CES1F2ALDH1A1ESR2
Terephthalic Acid SCHEMBL28056588 0.84 CA2 (0.47) CES2CES1MEN1KMT2A
Terephthalic Acid SCHEMBL28007787 0.84 CA2 (0.47) CES2CES1MEN1KMT2A
Acetic Acid SCHEMBL28062766 0.83 CA2 (0.36) CES2CES1F2ELANEALDH1A1
SCHEMBL28069546 0.81 — —
Terephthalic Acid SCHEMBL28067237 0.81 TSHR (0.45) CES2CES1ALDH1A1CYP2C9NPC1
Zinc Ion SCHEMBL28006153 0.80 — —

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-104610292-A Tetraphenyl ethylene tetra-triazole zinc nitrate complex with potential fluorescent material and preparation method of complex UNIV TIANJIN NORMAL 2015-05-13 — — CN disclosed
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