Bromide

Bromide

SCHEMBL18140459

CCCCCCCCCCCCCCC[N+](C)(CCO)Cc1ccccc1.[Br-]

nearest known ligand 0.64

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 0.47
CHRM2 known ✓ P08172 1/20 0.41
CHRM1 known ✓ P11229 1/20 0.41
CHRM3 known ✓ P20309 1/20 0.41
DNM1 Q05193 4/20 0.64
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
MAPK1 P28482 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
TP53 P04637 1/20 0.59
HTT P42858 3/20 0.58
BCHE P06276 1/20 0.47
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
CYP3A4 P08684 1/20 0.43
HIF1A Q16665 1/20 0.43
PSMD14 O00487 2/20 0.42
MMP2 P08253 2/20 0.42
RAD52 P43351 2/20 0.42
HSP90AA1 P07900 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
Bromide SCHEMBL18141522 1.00 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18139039 1.00 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18139921 1.00 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18140655 1.00 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18140552 1.00 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18141128 1.00 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18139973 1.00 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL4307685 0.98 DNM1 (0.63) DNM1MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL8871547 0.98 DNM1 (0.63) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL18140342 0.97 MEN1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2

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
US-10428194-B2 Modified acrylic resin cured product, and laminate thereof, and production methods therefor MITSUI CHEMICALS, INC. (JP) 2019-10-01 US disclosed
EP-3263635-B1 MODIFIED ACRYLIC RESIN CURED PRODUCT, AND LAMINATE THEREOF, AND PRODUCTION METHODS THEREFOR MITSUI CHEMICALS INC (JP) 2019-09-18 EP disclosed
US-20180163056-A1 HYDROPHILIC CURABLE COMPOSITIONS MITSUI CHEMICALS, INC. (JP) 2018-06-14 US disclosed
US-20180030230-A1 MODIFIED ACRYLIC RESIN CURED PRODUCT, AND LAMINATE THEREOF, AND PRODUCTION METHODS THEREFOR MITSUI CHEMICALS, INC. (JP) 2018-02-01 US disclosed
EP-3263635-A1 MODIFIED ACRYLIC RESIN CURED PRODUCT, AND LAMINATE THEREOF, AND PRODUCTION METHODS THEREFOR Mitsui Chemicals, Inc. (JP) 2018-01-03 EP disclosed
EP-3081578-A1 COMPOSITION FOR HYDROPHILIC CURED PRODUCT Mitsui Chemicals, Inc. (JP) 2016-10-19 EP disclosed
CN-105814092-A Composition for hydrophilic cured product 三井化学株式会社 2016-07-27 CN disclosed