Bromide

Bromide

SCHEMBL7379735

Br.CC/N=c1/scc(C2(c3ccc4ccccc4c3)CCC2)n1CC

nearest known ligand 0.35

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 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 14/20 0.35
SLC6A3 known ✓ Q01959 14/20 0.35
SLC6A2 known ✓ P23975 10/20 0.35
CYP2D6 P10635 4/20 0.33
OPRM1 P35372 1/20 0.32
KCNH2 Q12809 2/20 0.32

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 SCHEMBL7379737 1.00 SLC6A4 (0.35) SLC6A4SLC6A3SLC6A2CYP2D6OPRM1
SCHEMBL7382048 0.99 SLC6A4 (0.36) SLC6A4SLC6A3SLC6A2CYP2D6OPRM1
SCHEMBL7382049 0.99 SLC6A4 (0.36) SLC6A4SLC6A3SLC6A2CYP2D6OPRM1
Bromide SCHEMBL7384756 0.85 OPRM1 (0.34) SLC6A4SLC6A3SLC6A2CYP2D6OPRM1
Bromide SCHEMBL7384759 0.85 OPRM1 (0.34) SLC6A4SLC6A3SLC6A2CYP2D6OPRM1
Bromide SCHEMBL7383929 0.84 SLC6A4 (0.36) SLC6A4SLC6A3SLC6A2CYP2D6KCNH2
Bromide SCHEMBL7383928 0.84 SLC6A4 (0.36) SLC6A4SLC6A3SLC6A2CYP2D6KCNH2
SCHEMBL7384103 0.84 OPRM1 (0.35) SLC6A4SLC6A3SLC6A2CYP2D6OPRM1
SCHEMBL7384105 0.84 OPRM1 (0.35) SLC6A4SLC6A3SLC6A2CYP2D6OPRM1
Bromide SCHEMBL7384800 0.83 ALDH1A1 (0.32) SLC6A4SLC6A3SLC6A2CYP2D6OPRM1

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-0970090-B1 SUBSTITUTED 4-ARYLMETHYLENE-2-IMINO-2,3-DIHYDROTHIAZOLES AND DERIVATIVES AND THEIR PHARMACEUTICAL USE KNOLL GMBH (DE) 2002-06-05 EP disclosed
US-6187802-B1 3-(1-(3,4-DICHLOROPHENYL)CYCLOBUTYL)-5,6-DIHYDROIMIDAZO(2,1-B) THIAZOLE, FOR EXAMPLE; ADMINISTERING TO TREAT DEPRESSION, ANXIETY, PARKINSON'S DISEASE, OBESITY, COGNITIVE DISORDERS, SEIZURES, AND FOR NEUROPROTECTION AGAINST STROKE KNOLL AKTIENGESELLSCHAFT (DE) 2001-02-13 US disclosed
EP-0970090-A1 SUBSTITUTED 4-ARYLMETHYLENE-2-IMINO-2,3-DIHYDROTHIAZOLES AND DERIVATIVES AND THEIR PHARMACEUTICAL USE Knoll AG (DE) 2000-01-12 EP disclosed
WO-1998041528-A1 SUBSTITUTED 4-ARYLMETHYLENE-2-IMINO-2,3-DIHYDROTHIAZOLES AND DERIVATIVES AND THEIR PHARMACEUTICAL USE KNOLL AKTIENGESELLSCHAFT (DE) 1998-09-24 WO disclosed