Bromide

Bromide

SCHEMBL4086069

CCC[n+]1ccc(-c2cc[n+](CCC)cc2)cc1.[Br-].[Br-]

nearest known ligand 0.62

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 11/20 0.42
CHRM2 known ✓ P08172 1/20 0.39
CHRM4 known ✓ P08173 1/20 0.39
CHRM5 known ✓ P08912 1/20 0.39
CHRM1 known ✓ P11229 1/20 0.39
CHRM3 known ✓ P20309 1/20 0.39
KMT2A Q03164 3/20 0.62
MEN1 O00255 2/20 0.62
TP53 P04637 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2D6 P10635 1/20 0.62
MAPT P10636 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
HTT P42858 3/20 0.60
LMNA P02545 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
KDM4E B2RXH2 1/20 0.60
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60

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
SCHEMBL3211312 0.97 MEN1 (0.65) KMT2AMEN1TP53CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL4081103 0.94 MEN1 (0.62) KMT2AMEN1TP53CYP1A2CYP2D6
Fluoride Ion SCHEMBL11050205 0.94 MEN1 (0.62) KMT2AMEN1TP53CYP1A2CYP2D6
Bromide SCHEMBL21750926 0.91 KMT2A (0.54) KMT2AMEN1TP53CYP1A2CYP2D6
SCHEMBL3204759 0.90 MEN1 (0.58) KMT2AMEN1TP53CYP1A2CYP2D6
SCHEMBL3212692 0.87 MEN1 (0.56) KMT2AMEN1TP53CYP1A2CYP2D6
SCHEMBL16843092 0.87 MEN1 (0.56) KMT2AMEN1TP53CYP1A2CYP2D6
SCHEMBL8080641 0.87 TP53 (0.56) KMT2AMEN1TP53CYP1A2CYP2D6
Iodide SCHEMBL8080283 0.85 KDM4E (0.57) KMT2AMEN1TP53CYP1A2CYP2D6
Bromide SCHEMBL28311092 0.85 ACHE (0.54) KMT2AMEN1TP53CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180371310-A1 DYNAMIC RESPONSE COMPONENTS WITH AESTHETIC PROPERTIES FUNDACIÓN CIDETEC (ES) 2018-12-27 US disclosed
EP-3395927-A1 DYNAMIC RESPONSE COMPONENTS WITH AESTHETIC PROPERTIES Fundacion Cidetec (ES) 2018-10-31 EP disclosed
US-7500895-B2 Patterned substrate, electro-optical device, and method for manufacturing an electro-optical device SEIKO EPSON CORPORATION (JP) 2009-03-10 US disclosed
US-20060127563-A1 Patterned substrate, electro-optical device, and method for manufacturing an electro-optical device SEIKO EPSON CORPORATION (JP) 2006-06-15 US disclosed
US-20050287392-A1 Organic electroluminescent device, method for producing the same, and electronic apparatus SEIKO EPSON CORPORATION (JP) 2005-12-29 US disclosed