Bromide

Bromide

SCHEMBL4333656

Br.CC(C)(C)c1cc(C(=O)Cn2cc(C(=O)N3CCCC3)n(Cc3ccccc3)c2=N)cc(C(C)(C)C)c1O

nearest known ligand 0.59

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 5)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.44
F2R P25116 10/20 0.59
MAOB P27338 6/20 0.45
MAOA P21397 3/20 0.44
BCHE P06276 2/20 0.44

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
SCHEMBL6365089 0.99 F2R (0.60) F2RMAOBMAOABCHEACHE
SCHEMBL14369172 0.87 F2R (0.51) F2RMAOBMAOABCHEACHE
Bromide SCHEMBL4340412 0.84 F2R (0.62) F2RMAOBMAOABCHEACHE
SCHEMBL14346350 0.83 F2R (0.63) F2RMAOBMAOABCHEACHE
Bromide SCHEMBL4347253 0.83 F2R (0.67) F2RMAOBMAOABCHEACHE
SCHEMBL14346288 0.82 F2R (0.69) F2RMAOBMAOABCHEACHE
SCHEMBL4339115 0.82 F2R (0.61) F2RMAOBMAOABCHEACHE
Bromide SCHEMBL4340619 0.81 F2R (0.64) F2RMAOBMAOABCHEACHE
Bromide SCHEMBL4340422 0.80 F2R (0.63) F2RMAOBMAOABCHEACHE
SCHEMBL6360881 0.79 F2R (0.65) F2RMAOBMAOABCHEACHE

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
EP-1391456-B1 2-IMINOIMIDAZOLE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2009-07-22 EP disclosed
US-7304083-B2 2-iminoimidazole derivatives (2) EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-12-04 US disclosed