Bromide

Bromide

SCHEMBL8848908

CCOC(=O)C[n+]1ccc(/C=C/c2ccc(C=O)cc2)cc1.[Br-]

nearest known ligand 0.62

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 20)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 1/20 0.36
CHRM4 known ✓ P08173 1/20 0.36
CHRM5 known ✓ P08912 1/20 0.36
CHRM1 known ✓ P11229 1/20 0.36
CHRM3 known ✓ P20309 1/20 0.36
ACHE known ✓ P22303 1/20 0.36
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
KMT2A Q03164 4/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
CYP3A4 P08684 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
MEN1 O00255 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39

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 SCHEMBL5279859 1.00 CA12 (0.41) CA12CA1CA2CA7CA9
Bromide SCHEMBL8848766 0.87 ALDH1A1 (0.44) KMT2AALDH1A1MEN1
Bromide SCHEMBL8848768 0.87 ALDH1A1 (0.44) KMT2AALDH1A1MEN1
Bromide SCHEMBL19469275 0.86 CHRM2 (0.53) KMT2AKDM4EALDH1A1CTDSP1MEN1
Bromide SCHEMBL19469280 0.86 CHRM2 (0.53) KMT2AKDM4EALDH1A1CTDSP1MEN1
SCHEMBL29930859 0.85 CHRM2 (0.51) KMT2AKDM4EALDH1A1CTDSP1MEN1
SCHEMBL19506334 0.85 CHRM2 (0.51) KMT2AKDM4EALDH1A1CTDSP1MEN1
Bromide SCHEMBL5391070 0.85 KMT2A (0.43) CA12CA1CA2CA7CA9
Bromide SCHEMBL9243928 0.79 ALDH1A1 (0.47) KMT2AKDM4EALDH1A1CYP3A4MEN1
SCHEMBL8971275 0.77 ALDH1A1 (0.45) KMT2AKDM4EALDH1A1MEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0555070-B1 Photocurable compositions SERICOL LTD (GB) 1997-04-16 EP disclosed
US-5332651-A Screen printing SERICOL LIMITED (GB) 1994-07-26 US disclosed
EP-0555070-A1 Photocurable compositions SERICOL LIMITED (GB) 1993-08-11 EP disclosed