Bromide

Bromide

SCHEMBL14637403

C=CC(=O)NCCC[N+](C)(C)Cc1ccc(C[N+](C)(C)CCCNC(=O)C=C)cc1.[Br-].[Br-]

nearest known ligand 0.45

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
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45
KMT2A Q03164 2/20 0.45
ATM Q13315 1/20 0.45
TGM2 P21980 9/20 0.43
GAA P10253 1/20 0.43
DNM1 Q05193 2/20 0.39
PSMD14 O00487 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MMP2 P08253 1/20 0.37
MC4R P32245 1/20 0.37
RAD52 P43351 1/20 0.37
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
CBLB Q13191 1/20 0.36
MAPK1 P28482 2/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL16319751 0.98 ZDHHC20 (0.46) ZDHHC20ZDHHC2KMT2AATMTGM2
SCHEMBL18314763 0.94 ZDHHC20 (0.49) ZDHHC20ZDHHC2KMT2AATMTGM2
Bromide SCHEMBL28624083 0.93 TGM2 (0.52) ZDHHC20ZDHHC2KMT2AATMTGM2
SCHEMBL17858063 0.93 ZDHHC20 (0.45) ZDHHC20ZDHHC2KMT2AATMTGM2
SCHEMBL13903978 0.92 TGM2 (0.53) ZDHHC20ZDHHC2KMT2AATMTGM2
Water SCHEMBL9650629 0.90 TGM2 (0.52) ZDHHC20ZDHHC2KMT2AATMTGM2
Hydrochloric Acid SCHEMBL4995421 0.90 TGM2 (0.52) ZDHHC20ZDHHC2KMT2AATMTGM2
SCHEMBL14652639 0.89 TGM2 (0.45) ZDHHC20ZDHHC2KMT2AATMTGM2
Hydrochloric Acid SCHEMBL11576609 0.86 TGM2 (0.49) TGM2SMN1; SMN2ALDH1A1
SCHEMBL19458378 0.86 SIGMAR1 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2734292-B1 ION EXCHANGE MEMBRANES FUJIFILM MFG EUROPE BV (NL) 2021-11-03 EP disclosed
US-9309343-B2 Curable compositions and membranes FUJIFILM MANUFACTURING EUROPE BV (NL) 2016-04-12 US disclosed
US-20140378561-A1 Curable Compositions and Membranes FUJIFILM MANUFACTURING EUROPE BV (NL) 2014-12-25 US disclosed
EP-2734292-A1 CURABLE COMPOSITIONS AND MEMBRANES Fujifilm Manufacturing Europe BV (NL) 2014-05-28 EP disclosed
WO-2013011273-A1 CURABLE COMPOSITIONS AND MEMBRANES FUJIFILM MANUFACTURING EUROPE BV (NL) 2013-01-24 WO disclosed