Bromide

Bromide

SCHEMBL2992545

Br.CCCCC(N)(CCCC)C(CCC)(CCCC)CCCC

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 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 4/20 0.37
DNM1 Q05193 1/20 0.31
SMPD1 P17405 2/20 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
SCHEMBL11600521 0.83 FDPS (0.40) FDPSDNM1SMPD1
SCHEMBL16936158 0.82 SMPD1 (0.45) FDPSDNM1SMPD1
SCHEMBL3210177 0.82 SMPD1 (0.45) FDPSDNM1SMPD1
SCHEMBL3207013 0.82 SMPD1 (0.45) FDPSDNM1SMPD1
SCHEMBL16936118 0.82 SMPD1 (0.45) FDPSDNM1SMPD1
SCHEMBL272022 0.81 DNM1 (0.46) FDPSDNM1SMPD1
Fluoride SCHEMBL28863769 0.80 FDPS (0.37) FDPSSMPD1
SCHEMBL6742987 0.80 FDPS (0.41) FDPSDNM1SMPD1
Fluoride SCHEMBL2965507 0.80 FDPS (0.37) FDPSSMPD1
SCHEMBL6790923 0.78 FDPS (0.42) FDPSDNM1SMPD1

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-20100187467-A1 Aqueous solution for formation of clathrate hydrate, heat storage agent, method for producing clathrate hydrate or its slurry, heat accumulating and radiating method and method for preparing aqueous solution to produce latent heat storage agent or its major component JFE ENGINEERING CORPORATION 2010-07-29 US disclosed
EP-2210928-A1 AQUEOUS SOLUTION FOR CLATHRATE HYDRATE FORMATION, HEAT-STORAGE AGENT, PROCESS FOR PRODUCING CLATHRATE HYDRATE OR SLURRY THEREOF, METHOD OF STORING/RADIATING HEAT, AND PROCESS FOR PREPARING AQUEOUS SOLUTION FOR FORMING LATENT-HEAT-STORAGE AGENT OR MAJOR COMPONENT THEREOF JFE Engineering Corporation (JP) 2010-07-28 EP disclosed