Bromide

Bromide

SCHEMBL5250792

Br.C=C(C)C(=O)OCCOCCNC(C)(C)C

nearest known ligand 0.56

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 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.56
TSHR P16473 6/20 0.42
ALDH1A1 P00352 8/20 0.40
KDM4E B2RXH2 5/20 0.40
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 2/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 1/20 0.33
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 1/20 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 SCHEMBL11526296 0.91 THRB (0.47) THRBTSHRALDH1A1KDM4EMEN1
SCHEMBL16053018 0.91 THRB (0.50) THRBTSHRALDH1A1KDM4EMEN1
SCHEMBL26306 0.90 THRB (0.48) THRBTSHRALDH1A1KDM4EMEN1
Hydrochloric Acid SCHEMBL1396466 0.88 THRB (0.47) THRBTSHRALDH1A1KDM4EMEN1
Fluoride SCHEMBL8582115 0.88 THRB (0.47) THRBTSHRALDH1A1KDM4EMEN1
SCHEMBL6431278 0.87 THRB (0.47) THRBTSHRALDH1A1KDM4EMEN1
SCHEMBL8175481 0.85 ALDH1A1 (0.52) THRBTSHRALDH1A1KDM4EMEN1
Methacrylic Acid SCHEMBL8170359 0.85 THRB (0.44) THRBTSHRALDH1A1KDM4EMEN1
1,1-Dichloroethene SCHEMBL10925544 0.85 THRB (0.44) THRBTSHRALDH1A1KDM4EMEN1
SCHEMBL344387 0.83 TSHR (0.53) THRBTSHRALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0964878-B1 HYDROLYTICALLY STABLE RESINS FOR USE IN ANION-EXCHANGE CHROMATOGRAPHY DIONEX CORP (US) 2007-09-12 EP disclosed
EP-0964878-A4 HYDROLYTICALLY STABLE RESINS FOR USE IN ANION-EXCHANGE CHROMATOGRAPHY DIONEX CORP (US) 2004-12-22 EP disclosed
EP-0964878-A1 HYDROLYTICALLY STABLE RESINS FOR USE IN ANION-EXCHANGE CHROMATOGRAPHY DIONEX CORPORATION (US) 1999-12-22 EP disclosed
US-5936003-A RESIN SUPPORT PARTICLES AND ANION EXCHANGE COMPOUNDS ATTACHED WHEREIN THE ANION-EXCHANGE COMPOUNDS COMPRISE AN INTERNAL REACTIVE GROUP, WHICH MAY BE AN ESTER, KETONE OR AMIDE GROUP, AND A TERMINAL QUATERNARY AMMONIUM SALT WHICH FUNCTIONS AS AN DIONEX CORPORATION (US) 1999-08-10 US disclosed
US-5925253-A SYNTHETIC RESIN STATIONARY PHASE LINKED TO QUATERNIZED ANION-EXCHANGE SITES THROUGH REACTIVE GROUP AND ELONGATED LINKING ATOM CHAIN DIONEX CORPORATION (US) 1999-07-20 US disclosed
WO-1998039367-A1 HYDROLYTICALLY STABLE RESINS FOR USE IN ANION-EXCHANGE CHROMATOGRAPHY DIONEX CORPORATION (US) 1998-09-11 WO disclosed