Bromide

Bromide

SCHEMBL29044663

C=CC[N+](C)(C)Cc1ccc(C(=O)c2ccccc2)cc1.[Br-]

nearest known ligand 0.50

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 18)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 3/20 0.40
CHRM2 known ✓ P08172 1/20 0.40
ALDH1A1 P00352 7/20 0.50
HPGD P15428 3/20 0.47
LMNA P02545 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ELANE P08246 3/20 0.41
SRD5A2 P31213 1/20 0.41
ATM Q13315 1/20 0.40
BCHE P06276 1/20 0.40
CHRNA7 P36544 1/20 0.40
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
LSS P48449 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL14130437 0.98 ALDH1A1 (0.48) ALDH1A1HPGDLMNAL3MBTL1HTT
Hydrochloric Acid SCHEMBL27524153 0.97 ALDH1A1 (0.47) ALDH1A1HPGDLMNAL3MBTL1HTT
Bicarbonate SCHEMBL28038338 0.84 ALDH1A1 (0.46) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL28053725 0.83 ALDH1A1 (0.39) ALDH1A1HPGDLMNAL3MBTL1HTT
Bromide SCHEMBL231675 0.83 ALDH1A1 (0.48) ALDH1A1HPGDL3MBTL1HTTSMN1; SMN2
Bromide SCHEMBL152743 0.82 ALDH1A1 (0.50) ALDH1A1L3MBTL1HTTSMN1; SMN2ACHE
Bromide SCHEMBL2113979 0.82 ALDH1A1 (0.44) ALDH1A1HPGDLMNAL3MBTL1HTT
Bicarbonate SCHEMBL8962371 0.81 ALDH1A1 (0.44) ALDH1A1L3MBTL1HTTSMN1; SMN2ACHE
Acetic Acid SCHEMBL5720121 0.81 ALDH1A1 (0.44) ALDH1A1L3MBTL1HTTSMN1; SMN2ACHE
Bicarbonate SCHEMBL28038336 0.81 ALDH1A1 (0.44) ALDH1A1L3MBTL1HTTSMN1; SMN2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116119974-B Polycarboxylate superplasticizer applicable to plateau areas and preparation method thereof 石家庄市长安育才建材有限公司 2023-09-05 CN claimed
CN-116119974-A Polycarboxylate superplasticizer applicable to plateau areas and preparation method thereof 石家庄市长安育才建材有限公司 2023-05-16 CN claimed
CN-116119974-B Polycarboxylate superplasticizer applicable to plateau areas and preparation method thereof 石家庄市长安育才建材有限公司 2023-09-05 CN disclosed
CN-116119974-A Polycarboxylate superplasticizer applicable to plateau areas and preparation method thereof 石家庄市长安育才建材有限公司 2023-05-16 CN disclosed