Bromide

Bromide

SCHEMBL9737718

Br.Br.CN1CCC2=C(CNC2)C1

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

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 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 1/20 0.34
CHRM2 known ✓ P08172 1/20 0.32
CHRM3 known ✓ P20309 1/20 0.32
MAOA P21397 5/20 0.37
MAOB P27338 4/20 0.37
CYP2C19 P33261 1/20 0.34
SETD7 Q8WTS6 2/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD2 P14416 1/20 0.31
DRD1 P21728 1/20 0.31
DRD4 P21917 1/20 0.31
DRD5 P21918 1/20 0.31
DRD3 P35462 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CHRNA7 P36544 1/20 0.30

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 SCHEMBL9693044 0.83
SCHEMBL9842874 0.80
Bromide SCHEMBL9737932 0.75 MAOA (0.41) MAOAMAOBSLC6A4CYP2C19SETD7
SCHEMBL8342687 0.75 MAOA (0.44) MAOAMAOBSLC6A4CYP2C19SETD7
Bromide SCHEMBL9736341 0.73
SCHEMBL25774454 0.72
SCHEMBL17624446 0.72 MAOA (0.42) MAOAMAOBSLC6A4CYP2C19SETD7
SCHEMBL8803849 0.70 PNMT (0.35) SETD7CHRM3KDM4E
SCHEMBL14278211 0.69 MAOA (0.39) MAOAMAOBSLC6A4CYP2C19SETD7
SCHEMBL17721297 0.69 MAOA (0.39) MAOAMAOBSLC6A4CYP2C19SETD7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5089621-A Intermediates for cephalosporins or quinolone derivative antibiotics KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-02-18 US disclosed
EP-0424852-A1 Diazabicycloamine compounds and a process for their preparation KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1991-05-02 EP disclosed