Iodide

Iodide

SCHEMBL7930583

CCCC1=C([Zr+2]c2cccc3c2Cc2ccccc2-3)CC=C1.[I-].[I-]

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG

The experimentally established mechanism targets of Iodide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.36
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
DRD3 P35462 1/20 0.31

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
Hydrochloric Acid SCHEMBL7752720 0.91 PNMT (0.35) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL7553221 0.88 PNMT (0.38) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL6445067 0.86 PNMT (0.36) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL6471201 0.84 PNMT (0.35) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL6067454 0.82 PNMT (0.32) PNMTDRD2DRD4DRD3
Hydrochloric Acid SCHEMBL6067412 0.81 PNMT (0.31) PNMTDRD2DRD4DRD3
Hydrochloric Acid SCHEMBL2482352 0.79 PNMT (0.37) PNMTNPC1RAB9ADRD2DRD4
Iodide SCHEMBL7931462 0.74 PNMT (0.36) PNMTNPC1RAB9ADRD2DRD4
Iodide SCHEMBL7935539 0.74 PNMT (0.36) PNMTNPC1RAB9A
SCHEMBL7928034 0.72 PNMT (0.37) PNMTNPC1RAB9A

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-0946610-B1 HIGH ACTIVITY METALLOCENE POLYMERIZATION PROCESS EXXONMOBIL CHEM PATENTS INC (US) 2001-11-28 EP disclosed
US-6180736-B1 USING SUPPORT AND A COMPLEX FORMED BY ACTIVATING A GROUP 3, 4, 5, OR 6 METALLOCENE COMPRISING UNSUBSTITUTED (TETRAHYDRO) INDENYL LIGAND AND UNSUBSTITUTED CYCLOPENTADIENYL LIGAND; ETHYLENE POLYMERS WITH NARROW MOLECULAR WEIGHT DISTRIBUTION EXXON CHEMICAL PATENTS INC 2001-01-30 US disclosed
EP-0946610-A1 HIGH ACTIVITY METALLOCENE POLYMERIZATION PROCESS EXXON CHEMICAL PATENTS INC. (US) 1999-10-06 EP disclosed
WO-1998028350-A1 HIGH ACTIVITY METALLOCENE POLYMERIZATION PROCESS EXXON CHEMICAL PATENTS INC. (US) 1998-07-02 WO disclosed