Bromide

Bromide

SCHEMBL11435482

CCc1ccc(C)[n+](CC)c1.[Br-]

nearest known ligand 0.38

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
CA2 P00918 1/20 0.38
TP53 P04637 2/20 0.37
TAAR1 Q96RJ0 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
LMNA P02545 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
APOBEC3A P31941 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
CYP2A6 P11509 1/20 0.35
LPL P06858 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL641259 0.98 CA2 (0.39) CA2TP53TAAR1SMN1; SMN2LMNA
Iodide SCHEMBL4336770 0.96 SMN1; SMN2 (0.39) CA2TP53TAAR1SMN1; SMN2LMNA
Bromide SCHEMBL10844297 0.83 CA2 (0.35) CA2TP53TAAR1SMN1; SMN2LMNA
Bromide SCHEMBL8658730 0.77 SMN1; SMN2 (0.44) CA2TP53SMN1; SMN2LMNAKDM4E
Bromide SCHEMBL10858949 0.77 SMN1; SMN2 (0.44) CA2TP53SMN1; SMN2LMNAKDM4E
Hydrochloric Acid SCHEMBL11428178 0.76 LPL (0.35) CA2TP53TAAR1SMN1; SMN2CYP2A6
SCHEMBL8723606 0.76 KDM4E (0.36) CA2TP53TAAR1SMN1; SMN2LMNA
Bromide SCHEMBL11581070 0.76 TP53 (0.47) CA2TP53TAAR1SMN1; SMN2LMNA
SCHEMBL1105765 0.75 LMNA (0.43) SMN1; SMN2LMNAKDM4EMEN1APOBEC3A
Hydrochloric Acid SCHEMBL11442433 0.74 HTT (0.42) CA2TP53SMN1; SMN2LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4228230-A Ultrasonic imaging of internally fogged silver halide elements EASTMAN KODAK COMPANY (US) 1980-10-14 US disclosed