Bromide

Bromide

SCHEMBL11339396

Br.Br.C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3

nearest known ligand 0.41

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 2)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.41
▸ STAT1 P42224 1/20 0.41

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 SCHEMBL11339399 1.00 STAT3 (0.41) STAT3STAT1
Bromide SCHEMBL30298469 1.00 STAT3 (0.41) STAT3STAT1
Bromide SCHEMBL28931362 1.00 STAT3 (0.41) STAT3STAT1
Bromide SCHEMBL27545239 1.00 STAT3 (0.41) STAT3STAT1
Bromide SCHEMBL28209978 0.97 STAT3 (0.40) STAT3STAT1
Bromide SCHEMBL11337794 0.97 STAT3 (0.40) STAT3STAT1
SCHEMBL6517023 0.97 STAT3 (0.42) STAT3STAT1
SCHEMBL15809 0.97 STAT3 (0.42) STAT3STAT1
SCHEMBL29430977 0.97 STAT3 (0.42) STAT3STAT1
SCHEMBL9430673 0.97 STAT3 (0.42) STAT3STAT1

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-4256597-A DETERGENT AND PHOTOINITIATOR COMPRISING A PORPHINE OR MONO, DI, OR TRIAZO PORPHINE, OR PHTHALOCYANINE COMPOUND; WATER SOLUBILITY; STAIN REMOVAL THE PROCTER & GAMBLE COMPANY (US) 1981-03-17 — — US disclosed
US-4255273-A COMPRISING A WATER-SOLUBLE PHOTOACTIVATOR AND A CATIONIC SUBSTANCE THE PROCTER & GAMBLE COMPANY (US) 1981-03-10 — — US disclosed
Send feedback