Bromide

Bromide

SCHEMBL14765114

Cn1cc[n+](CCC[n+]2ccn(C)c2)c1.[Br-].[Br-]

nearest known ligand 0.39

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 2)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.35
BCHE P06276 1/20 0.35

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
SCHEMBL6115257 0.98 BCHE (0.33) BCHEACHE
Bromide SCHEMBL18834189 0.93 BCHE (0.41) BCHEACHE
Bromide SCHEMBL17395314 0.93 BCHE (0.41) BCHEACHE
Bromide SCHEMBL20495999 0.93 BCHE (0.41) BCHEACHE
SCHEMBL8738994 0.93
SCHEMBL11999066 0.91 BCHE (0.39) BCHEACHE
SCHEMBL12891417 0.91 BCHE (0.39) BCHEACHE
Iodide SCHEMBL2530880 0.91 KDM4E (0.34)
SCHEMBL11999067 0.91 BCHE (0.39) BCHEACHE
SCHEMBL17395281 0.91 BCHE (0.39) BCHEACHE

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
WO-2013034762-A1 PROCESS FOR WATER OXIDATION AND TRANSITION METAL CATALYSTS THEREFORE UNIVERSITEIT VAN AMSTERDAM (NL) 2013-03-14 WO disclosed