Bromide

Bromide

SCHEMBL7201341

COc1cccc(C[P+](c2ccc(C)cc2)(c2ccc(C)cc2)c2ccc(C)cc2)c1.[Br-]

nearest known ligand 0.53

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 13)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.46
CHRM2 known ✓ P08172 1/20 0.44
CHRM1 known ✓ P11229 1/20 0.44
CHRM3 known ✓ P20309 1/20 0.44
TAAR1 Q96RJ0 3/20 0.53
MAOB P27338 3/20 0.50
IDO1 P14902 2/20 0.46
AGXT P21549 2/20 0.46
MMP13 P45452 1/20 0.44
CMA1 P23946 1/20 0.43
SIGMAR1 Q99720 1/20 0.42
AOC3 Q16853 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
Iodide SCHEMBL7197885 0.97 TAAR1 (0.53) TAAR1MAOBIDO1AGXTACHE
Hydrochloric Acid SCHEMBL7198118 0.97 TAAR1 (0.53) TAAR1MAOBIDO1AGXTACHE
Phosphoric Acid SCHEMBL7197903 0.90 TAAR1 (0.47) TAAR1MAOBIDO1AGXTACHE
Acetic Acid SCHEMBL8750051 0.89 L3MBTL1 (0.47) TAAR1MAOBMMP13L3MBTL1
Bromide SCHEMBL7200811 0.88 ACHE (0.55) TAAR1MAOBIDO1AGXTACHE
Bromide SCHEMBL3110986 0.87 TAAR1 (0.56) TAAR1MAOBIDO1AGXTCHRM2
Succinic Acid SCHEMBL7197926 0.87 L3MBTL1 (0.48) TAAR1MAOBMMP13L3MBTL1
Acetic Acid SCHEMBL7197934 0.87 L3MBTL1 (0.46) TAAR1MAOBMMP13L3MBTL1
SCHEMBL31208272 0.85 TAAR1 (0.57) TAAR1MAOBIDO1AGXTCHRM2
Phosphoric Acid SCHEMBL9318089 0.85 MAOB (0.42) TAAR1MAOBIDO1AGXTACHE

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 7 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 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