Bromide

Bromide

SCHEMBL5148024

NC(=O)c1ccc(C[n+]2cccc(C(=O)O)c2)cc1.NC(=O)c1ccc[n+](Cc2ccccc2)c1.[Br-].[F-]

nearest known ligand 0.77

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 16)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.43
NPSR1 Q6W5P4 1/20 0.77
L3MBTL1 Q9Y468 1/20 0.77
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
HSP90AA1 P07900 3/20 0.51
MAPT P10636 2/20 0.49
PLA2G10 O15496 1/20 0.49
PLA2G2A P14555 1/20 0.49
ALDH1A1 P00352 1/20 0.46
NPC1 O15118 1/20 0.46
CYP2D6 P10635 1/20 0.44
ATM Q13315 1/20 0.44
BCHE P06276 1/20 0.43
LMNA P02545 1/20 0.43
BACE1 P56817 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
Fluoride Ion SCHEMBL5148076 0.95 L3MBTL1 (0.71) NPSR1L3MBTL1KMT2AMEN1HSP90AA1
Fluoride Ion SCHEMBL5150138 0.92 NPSR1 (0.76) NPSR1L3MBTL1KMT2AMEN1HSP90AA1
Hydrochloric Acid SCHEMBL5148138 0.92 L3MBTL1 (0.71) NPSR1L3MBTL1KMT2AMEN1HSP90AA1
Bromide SCHEMBL5148142 0.92 NPSR1 (0.76) NPSR1L3MBTL1KMT2AMEN1HSP90AA1
SCHEMBL3913983 0.90 NPSR1 (0.78) NPSR1L3MBTL1KMT2AMEN1HSP90AA1
Fluoride Ion SCHEMBL5148073 0.90 NPSR1 (0.77) NPSR1L3MBTL1KMT2AMEN1HSP90AA1
Bromide SCHEMBL3072258 0.90 NPSR1 (0.94) NPSR1L3MBTL1KMT2AMEN1HSP90AA1
Bromide SCHEMBL5146810 0.90 NPSR1 (0.77) NPSR1L3MBTL1KMT2AMEN1HSP90AA1
Hydrochloric Acid SCHEMBL2770251 0.89 NPSR1 (0.76) NPSR1L3MBTL1KMT2AMEN1HSP90AA1
SCHEMBL1982654 0.89 L3MBTL1 (0.97) NPSR1L3MBTL1KMT2AMEN1HSP90AA1

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
EP-1870495-A1 Aqueous alkaline, cyanide-free, bath for the galvanic deposition of Zinc and Zinc alloy layers ATOTECH DEUTSCHLAND GMBH (DE) 2007-12-26 EP disclosed