Bromide

Bromide

SCHEMBL7196672

CCCC[P+](c1ccc(C)cc1)(c1ccc(C)cc1)c1ccc(C)cc1.[Br-]

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.35
HRH3 Q9Y5N1 1/20 0.39
HTT P42858 1/20 0.36
HIF1A Q16665 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
PTGES O14684 1/20 0.35
ALOX5 P09917 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
DNM1 Q05193 1/20 0.34
BDKRB2 P30411 2/20 0.34
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HPGD P15428 1/20 0.33
TLR8 Q9NR97 1/20 0.33
SLC6A4 P31645 1/20 0.32
MCHR1 Q99705 1/20 0.32
MEN1 O00255 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 SCHEMBL23852358 0.94 BDKRB2 (0.40) HRH3HTTHIF1AACHETDP1
Hydrochloric Acid SCHEMBL23852343 0.89 BDKRB2 (0.40) HRH3HTTHIF1AACHETDP1
Iodide SCHEMBL23853413 0.89 HTT (0.39) HRH3HTTHIF1AACHETDP1
Hydrochloric Acid SCHEMBL6310910 0.88 HTT (0.42) HRH3HTTDNM1BDKRB2L3MBTL1
Bromide SCHEMBL7611775 0.85 HIF1A (0.47) HTTHIF1ADNM1
Butyltriphenylphosphonium SCHEMBL28224488 0.84 HIF1A (0.50) HIF1AACHE
Bromide SCHEMBL7194017 0.81 HIF1A (0.34) HIF1AACHETDP1SLC6A4MEN1
Butyltriphenylphosphonium SCHEMBL1063 0.80 HIF1A (0.61) HIF1AMEN1KMT2A
Bromide SCHEMBL23038696 0.79 TRAP1 (0.34) PTGESALOX5PPARGPPARAMEN1
Butyltriphenylphosphonium SCHEMBL2650050 0.78 HIF1A (0.58) HIF1AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0624173-B2 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS DOW CHEMICAL CO (US) 2003-04-09 EP claimed
EP-0624173-B2 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS DOW CHEMICAL CO (US) 2003-04-09 EP disclosed
EP-0624173-B1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS DOW CHEMICAL CO (US) 1997-04-02 EP disclosed
EP-0624173-A1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS. DOW CHEMICAL CO (US) 1994-11-17 EP disclosed
US-5360886-A Alklyphenylphosphine or phosphonium catalyst THE DOW CHEMICAL COMPANY (US) 1994-11-01 US disclosed
US-5310853-A Epoxy resins THE DOW CHEMICAL COMPANY (US) 1994-05-10 US disclosed
WO-1993015126-A1 PRECATALYZED CATALYST COMPOSITIONS, PROCESS FOR PREPARING RESINS THE DOW CHEMICAL COMPANY (US) 1993-08-05 WO disclosed
US-5202407-A Phosphonium or phosphine catalyst having at least three alkylphenyl groups attached to phosphorus atom THE DOW CHEMICAL COMPANY (US) 1993-04-13 US disclosed