Bromide

Bromide

SCHEMBL727799

Br.Br.Br.[Ti]Oc1ccccc1

nearest known ligand 0.50

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 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.33
LTA4H P09960 4/20 0.50
TSHR P16473 2/20 0.50
CA4 P22748 1/20 0.45
KCNA3 P22001 1/20 0.41
CA5A P35218 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
NR1H2 P55055 1/20 0.38
BAX Q07812 1/20 0.38
MAOA P21397 1/20 0.38
ALDH1A1 P00352 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
TAAR1 Q96RJ0 1/20 0.36
RECQL P46063 1/20 0.36
CA9 Q16790 1/20 0.36
SRC P12931 1/20 0.36
HSD17B10 Q99714 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35

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
SCHEMBL2476774 0.97
SCHEMBL3081684 0.93
Hydrochloric Acid SCHEMBL3355123 0.93 LTA4H (0.50) LTA4HTSHRCA4KCNA3CA5A
Hydrochloric Acid SCHEMBL1982434 0.93
Hydrochloric Acid SCHEMBL301557 0.93 LTA4H (0.50) LTA4HTSHRCA4KCNA3CA5A
SCHEMBL3068689 0.93
Hydrochloric Acid SCHEMBL18340209 0.81 CA4 (0.48) LTA4HTSHRCA4KCNA3CA5A
Diphenylether SCHEMBL6889917 0.72 LTA4H (0.92) LTA4HTSHRCA4NR1H2BAX
Diphenylether SCHEMBL2886896 0.72 LTA4H (0.92) LTA4HTSHRCA4NR1H2BAX
Hydrochloric Acid SCHEMBL4062895 0.72 MAOA (0.43) LTA4HMAOAALDH1A1MAOB

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 243 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572752-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2014-08-13 EP claimed
EP-1578806-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2013-05-22 EP claimed
EP-1572753-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2012-06-13 EP claimed
EP-1761574-B1 POLYMERIZATION PROCESS USING HYDROFLUOROCARBONS EXXONMOBIL CHEM PATENTS INC (US) 2012-06-13 EP claimed
US-8178465-B2 Polydispersity-controlled isoolefin polymerization with polymorphogenates EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-05-15 US claimed
JP-4729040-B2 2011-07-20 JP claimed
US-20110111950-A1 Polydispersity-Controlled Isoolefin Polymerization With Polymorphogenates EXXONMOBIL CHEMICAL PATENTS INC. 2011-05-12 US claimed
US-7781547-B2 Reactor systems for use in polymerization processes EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-08-24 US claimed
EP-1572751-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2010-06-23 EP claimed
US-7723447-B2 slurry polymerization in presence a cationic catalyst system, an environmentally friendly hydrofluorocarbon diluent, of one or more monomer(s) to form a single phase polymerization medium; prevent agglomeration and reactor fouling; utilizing boiling pool reactor systems EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-05-25 US claimed
EP-1572763-A2 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS ExxonMobil Chemical Patents Inc. (US) 2005-09-14 EP claimed
US-20050107536-A1 Polymers with new sequence distributions EXXONMOBIL CHEMICAL PATENTS INC. 2005-05-19 US claimed
US-20050101751-A1 Halogenated polymers with new sequence distributions EXXONMOBIL CHEMICAL PATENTS INC. 2005-05-12 US claimed
WO-2004067577-A2 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-08-12 WO claimed
WO-2004058829-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2004-07-15 WO claimed
WO-2004058836-A1 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058828-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058825-A2 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2004-07-15 WO claimed
WO-2004058827-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058835-A1 POLYMERS SUBSTANTIALLY FREE OF LONG CHAIN BRANCHING EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed