Bromide

Bromide

SCHEMBL7939131

C1=CCC([Hf+2]c2cccc3c2Cc2ccccc2-3)=C1.[Br-].[Br-]

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32
PGR P06401 1/20 0.32

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 SCHEMBL3041073 0.97 PNMT (0.39) PNMTNPC1RAB9AHTR7HTR2B
Iodide SCHEMBL7921884 0.97 PNMT (0.39) PNMTNPC1RAB9AHTR7HTR2B
Hydrochloric Acid SCHEMBL29695725 0.78 PNMT (0.50) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL8379134 0.78 PNMT (0.50) PNMTNPC1RAB9AHTR7HTR2B
Hydrochloric Acid SCHEMBL816978 0.78 PNMT (0.50) PNMTNPC1RAB9AHTR7HTR2B
Hydrochloric Acid SCHEMBL9412846 0.77 MAPT (0.39) NPC1RAB9ADRD2DRD3
Hydrochloric Acid SCHEMBL4890082 0.72 PNMT (0.37) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL27348144 0.72 PNMT (0.45) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL28220071 0.71 PNMT (0.44) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL28286932 0.71 PNMT (0.44) PNMTNPC1RAB9AHTR7HTR2B

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
EP-0946610-B1 HIGH ACTIVITY METALLOCENE POLYMERIZATION PROCESS EXXONMOBIL CHEM PATENTS INC (US) 2001-11-28 EP disclosed