Bromide

Bromide

SCHEMBL4619927

COc1ccc2c(c1)c(/C=C/N(C(C)=O)c1ccccc1)cc[n+]2CCC[N+](C)(C)C.[Br-].[Br-]

nearest known ligand 0.44

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
ACHE known ✓ P22303 2/20 0.31
LMNA P02545 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPK1 P28482 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
POLB P06746 1/20 0.44
THRB P10828 1/20 0.44
HTT P42858 1/20 0.44
BLM P54132 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
APOBEC3A P31941 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
RXFP1 Q9HBX9 1/20 0.34
PPM1A P35813 2/20 0.34

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 SCHEMBL4619930 1.00 LMNA (0.44) LMNAMEN1KMT2AKDM4EMAPK1
Bromide SCHEMBL4619455 0.87 POLB (0.38) LMNAMEN1KMT2AKDM4EMAPK1
Bromide SCHEMBL4619451 0.87 POLB (0.38) LMNAMEN1KMT2AKDM4EMAPK1
Bromide SCHEMBL4620814 0.73 KDM4E (0.35) LMNAMEN1KMT2AKDM4EMAPK1
Bromide SCHEMBL4620811 0.73 KDM4E (0.35) LMNAMEN1KMT2AKDM4EMAPK1
Bromide SCHEMBL4620833 0.71 NPC1 (0.55) LMNAMEN1KMT2AKDM4EALDH1A1
Iodide SCHEMBL10479085 0.70 MAPT (0.55) LMNAMEN1KMT2AKDM4EMAPK1
Bromide SCHEMBL6865008 0.68 ACHE (0.56) ACHE
SCHEMBL14365143 0.68 MEN1 (0.49) LMNAMEN1KMT2AKDM4EMAPK1
Iodide SCHEMBL10745058 0.65 MAPT (0.55) LMNAMEN1KMT2AKDM4EMAPK1

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
US-20080124732-A1 METHOD FOR OPTICAL MEASUREMENT OF MULTI-STRANDED NUCLEIC ACID FUJIFILM CORPORATION 2008-05-29 US disclosed
EP-1889880-A2 Method for optical measurement of multi-stranded nucleic acid FUJIFILM Corporation (JP) 2008-02-20 EP disclosed
EP-1362894-B1 Method for optical measurement of multi-stranded nucleic acid using cyanine dyes FUJIFILM CORP (JP) 2007-12-19 EP disclosed
US-20050112770-A1 Method for optical measurement of multi-stranded nucleic acid FUJI PHOTO FILM CO., LTD. 2005-05-26 US disclosed
EP-1362894-A2 Method for optical measurement of multi-stranded nucleic acid using cyanine dyes FUJI PHOTO FILM CO., LTD. (JP) 2003-11-19 EP disclosed