Bromide

Bromide

SCHEMBL5149965

C#CC[n+]1cccc(C(=O)O)c1.[Br-]

nearest known ligand 0.47

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
KMT2A Q03164 5/20 0.47
MEN1 O00255 2/20 0.47
NPSR1 Q6W5P4 2/20 0.42
PABPC1 P11940 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GLA P06280 1/20 0.40
CYP2D6 P10635 2/20 0.39
MAPT P10636 2/20 0.38
HSP90AA1 P07900 3/20 0.38
DAO P14920 1/20 0.38
TSHR P16473 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
LMNA P02545 3/20 0.37
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
APAF1 O14727 1/20 0.37
USP2 O75604 1/20 0.37
XBP1 P17861 1/20 0.37
HTT P42858 1/20 0.37

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 SCHEMBL5146756 0.97 KMT2A (0.47) KMT2AMEN1NPSR1PABPC1ATM
Hydrochloric Acid SCHEMBL5146805 0.97 KMT2A (0.47) KMT2AMEN1NPSR1PABPC1ATM
Bromide SCHEMBL5150406 0.85 NPSR1 (0.55) KMT2AMEN1NPSR1ATML3MBTL1
Fluoride Ion SCHEMBL5148030 0.82 NPSR1 (0.55) KMT2AMEN1NPSR1ATML3MBTL1
Hydrochloric Acid SCHEMBL2810527 0.82 NPSR1 (0.55) KMT2AMEN1NPSR1ATML3MBTL1
Bromide SCHEMBL17906576 0.81 KMT2A (0.52) KMT2AMEN1NPSR1PABPC1ATM
Bromide SCHEMBL29902123 0.81 KMT2A (0.52) KMT2AMEN1NPSR1PABPC1ATM
SCHEMBL9811331 0.75 KMT2A (0.53) KMT2AMEN1NPSR1PABPC1ATM
SCHEMBL10307407 0.75 KMT2A (0.53) KMT2AMEN1NPSR1PABPC1ATM
Bromide SCHEMBL5146792 0.75 NPSR1 (0.71) KMT2AMEN1NPSR1PABPC1ATM

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