Bromide

Bromide

SCHEMBL7965212

O=[N+]([O-])c1ccc(C[n+]2ccccc2)cc1.[Br-]

nearest known ligand 0.69

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 0.49
MEN1 O00255 3/20 0.69
KMT2A Q03164 3/20 0.69
ALDH1A1 P00352 2/20 0.69
MAPT P10636 2/20 0.69
KDM4E B2RXH2 2/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
LMNA P02545 2/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
POLB P06746 1/20 0.51
APOBEC3A P31941 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
LTA4H P09960 1/20 0.50
PLA2G2A P14555 1/20 0.50
HSP90AA1 P07900 1/20 0.50
RAB9A P51151 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
BCHE P06276 1/20 0.49
LOXL2 Q9Y4K0 1/20 0.48

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
SCHEMBL8733830 0.98 ALDH1A1 (0.71) MEN1KMT2AALDH1A1MAPTKDM4E
Hydrochloric Acid SCHEMBL11134565 0.96 ALDH1A1 (0.74) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL9505752 0.88 ALDH1A1 (0.63) MEN1KMT2AALDH1A1MAPTKDM4E
Bromide SCHEMBL8664123 0.85 MEN1 (0.94) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL9241499 0.85 MEN1 (0.60) MEN1KMT2AALDH1A1MAPTKDM4E
Bromide SCHEMBL29278162 0.83 LMNA (0.68) MEN1KMT2AALDH1A1MAPTKDM4E
Bromide SCHEMBL28605769 0.83 ALDH1A1 (0.61) MEN1KMT2AALDH1A1MAPTKDM4E
Bromide SCHEMBL11681833 0.83 KMT2A (0.56) MEN1KMT2AALDH1A1MAPTKDM4E
Hydrochloric Acid SCHEMBL11134568 0.82 ALDH1A1 (0.79) MEN1KMT2AALDH1A1MAPTKDM4E
Bromide SCHEMBL2831425 0.80 ACHE (0.68) ALDH1A1SMN1; SMN2LMNABCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117402141-A Fluorescent probe and preparation method and application thereof 上海工程技术大学 2024-01-16 CN disclosed
CN-109423291-B Etching solution for selectively removing silicon-germanium alloy from silicon-germanium/silicon stack in the manufacture of semiconductor devices 弗萨姆材料美国有限责任公司 2022-09-30 CN disclosed
WO-2001060781-A2 DIPHENYL COMPOUNDS, FORMULATIONS AND USES THEREOF UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2001-08-23 WO disclosed