Bromide

Bromide

SCHEMBL4622171

C=Cc1cc[n+](CCC)cc1.[Br-]

nearest known ligand 0.52

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 3/20 0.38
CHRM2 known ✓ P08172 1/20 0.34
CHRM4 known ✓ P08173 1/20 0.34
CHRM5 known ✓ P08912 1/20 0.34
CHRM1 known ✓ P11229 1/20 0.34
CHRM3 known ✓ P20309 1/20 0.34
HDAC8 Q9BY41 2/20 0.52
HTT P42858 3/20 0.43
MEN1 O00255 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
APAF1 O14727 1/20 0.43
HSP90AA1 P07900 1/20 0.43
MAPK1 P28482 1/20 0.43
BLM P54132 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4A O75164 2/20 0.38
KDM2A Q9Y2K7 2/20 0.38

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
SCHEMBL20847841 0.98 HDAC8 (0.54) HDAC8HTTMEN1MAPTKMT2A
Bromide SCHEMBL1674572 0.88 HTT (0.53) HDAC8HTTMEN1MAPTKMT2A
Water SCHEMBL11152895 0.86 HTT (0.51) HDAC8HTTMEN1MAPTKMT2A
SCHEMBL4653273 0.85 HTT (0.50) HDAC8HTTMEN1MAPTKMT2A
Bromide SCHEMBL2043943 0.84 HDAC8 (0.54) HDAC8HTTMEN1MAPTKMT2A
Bromide SCHEMBL153043 0.84 HDAC8 (0.54) HDAC8HTTMEN1MAPTKMT2A
Bromide SCHEMBL9819629 0.84 KMT2A (0.63) HTTMEN1MAPTKMT2ASMN1; SMN2
Bromide SCHEMBL3703072 0.84 KMT2A (0.63) HTTMEN1MAPTKMT2ASMN1; SMN2
Bromide SCHEMBL692643 0.84 KMT2A (0.63) HTTMEN1MAPTKMT2ASMN1; SMN2
Bromide SCHEMBL5586546 0.84 KMT2A (0.63) HTTMEN1MAPTKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1517990-B1 ISOLATION OF NUCLEIC ACIDS USING A POLYCATIONIC POLYMER AS PRECIPITATION AGENT GE HEALTHCARE BIO SCIENCES AB (SE) 2008-03-19 EP disclosed
US-20050222404-A1 Isolation of nucleic acids using a polycationic polymer as precipitation agent GE HEALTHCARE BIO-SCIENCES AB (SE) 2005-10-06 US disclosed
EP-1517990-A1 ISOLATION OF NUCLEIC ACIDS USING A POLYCATIONIC POLYMER AS PRECIPITATION AGENT Amersham Biosciences AB (SE) 2005-03-30 EP disclosed
WO-2004003200-A1 ISOLATION OF NUCLEIC ACIDS USING A POLYCATIONIC POLYMER AS PRECIPITATION AGENT AMERSHAM BIOSCIENCES AB (SE) 2004-01-08 WO disclosed