Bromide

Bromide

SCHEMBL11250602

Br.Cc1ccc(CC2(Cn3ccnc3)OCC(C)O2)cc1

nearest known ligand 0.65

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 4)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 2/20 0.65
CYP19A1 P11511 1/20 0.46
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46

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
SCHEMBL11248535 0.99 HMOX1 (0.66) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11241491 0.90 HMOX1 (0.80) HMOX1
SCHEMBL11239437 0.88 HMOX1 (0.64) HMOX1
SCHEMBL11241840 0.88 HMOX1 (0.58) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11244850 0.88 HMOX1 (0.84) HMOX1
SCHEMBL11236454 0.87 HMOX1 (0.66) HMOX1CYP19A1CYP11B1
SCHEMBL11252474 0.87 HMOX1 (0.62) HMOX1
SCHEMBL11241841 0.87 HMOX1 (0.62) HMOX1
SCHEMBL11251950 0.86 HMOX1 (0.56) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11248183 0.86 HMOX1 (0.74) HMOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4321272-A Derivatives of substituted N-alkylimidazoles SYNTEX (U.S.A.) INC. (US) 1982-03-23 US disclosed