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Zinc Ion

Zinc Ion

SCHEMBL7089336

CC(C)(c1ccccc1)c1cc(C(=O)[O-])c(O)c(C(C)(C)c2ccccc2)c1.CC(C)(c1ccccc1)c1cc(C(=O)[O-])c(O)c(C(C)(C)c2ccccc2)c1.[Zn+2]

nearest known ligand 0.42

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 2/20 0.42
▸ ESR2 Q92731 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CNR1 P21554 4/20 0.39
▸ CNR2 P34972 4/20 0.39
▸ NR5A2 O00482 1/20 0.37
▸ NR5A1 Q13285 1/20 0.37
▸ NR3C2 P08235 2/20 0.36
▸ PKLR P30613 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ GPR35 Q9HC97 1/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CYP2C19 P33261 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ HDAC3 O15379 1/20 0.33

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
Water SCHEMBL9852465 0.99 ESR1 (0.41) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL9700994 0.97 ALDH1A1 (0.42) ESR1ESR2ALDH1A1CYP3A4CNR1
Zinc Ion SCHEMBL11771848 0.87 ALDH1A1 (0.38) ESR1ESR2ALDH1A1CYP3A4CNR1
Zinc Ion SCHEMBL7089200 0.87 SHBG (0.36) ESR1ESR2ALDH1A1CYP3A4NR5A2
Zinc Ion SCHEMBL7087886 0.87 ESR1 (0.43) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL1129729 0.86 ESR1 (0.46) ESR1ESR2ALDH1A1CYP3A4CNR1
Zinc Ion SCHEMBL7089975 0.86 PTPN1 (0.41) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL7084776 0.85 ESR1 (0.44) ESR1ESR2ALDH1A1CYP3A4CNR1
Water SCHEMBL9852464 0.85 ESR1 (0.44) ESR1ESR2ALDH1A1CYP3A4CNR1
SCHEMBL11758522 0.84 ALDH1A1 (0.38) ESR1ESR2ALDH1A1CYP3A4CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3983292-A Pressure sensitive recording papers SANKO CHEMICAL COMPANY LTD. (JA) 1976-09-28 — — US claimed
US-20030191023-A1 Thermosensitive recording material FUJI PHOTO FILM CO., LTD. 2003-10-09 — — US disclosed
EP-0268878-B1 Salicylic acid copolymers and their metal salts, production process thereof, color-developing agents comprising metal salts of the copolymers and color-developing sheets employing the agents MITSUI TOATSU CHEMICALS (JP) 1996-01-31 — — EP disclosed
US-5107006-A Photostabilizers developers SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1992-04-21 — — US disclosed
US-5023366-A Reacted with a benzyl halide, alcohol or ether; for pressure sensitive elements MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1991-06-11 — — US disclosed
US-4920186-A MODIFIED WITH A POLYVALENT METAL-BOUND CARBOXYL GROUP; NONYELLOWING, RESISTANCE TO LIGHT AND WATER SUMITOMO DUREZ COMPANY, LTD. (JP) 1990-04-24 — — US disclosed
EP-0268878-A2 Salicylic acid copolymers and their metal salts, production process thereof, color-developing agents comprising metal salts of the copolymers and color-developing sheets employing the agents MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-06-01 — — EP disclosed
US-4257935-A CONTAINING AN ORGANIC COLOR DEVELOPER AND A POLYMERIC OLEFIN-CONJUGATED DIENE TYPE BINDER SUMITOMO NAUGATUCK CO., LTD. (JP) 1981-03-24 — — US disclosed
US-4125675-A Color developing sheet with organic developer and latex binder SUMITOMO NAUGATUCK CO., LTD. (JP) 1978-11-14 — — US disclosed
US-4046941-A PRESSURE SENSITIVE COPYING SANKO CHEMICAL COMPANY LTD. (JA) 1977-09-06 — — US disclosed