Bromide

Bromide

SCHEMBL11558248

Br.C=CCN1CN(CC(=O)OCC)c2ccccc21

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

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 11)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.46
▸ ALDH1A1 P00352 5/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ MAPT P10636 2/20 0.42
▸ KDM4E B2RXH2 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ LMNA P02545 3/20 0.41
▸ TSHR P16473 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40

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 SCHEMBL11561174 0.85 MEN1 (0.49) NPSR1ALDH1A1MEN1KMT2AKDM4E
Bromide SCHEMBL11559553 0.82 MEN1 (0.47) NPSR1ALDH1A1MEN1KMT2ALMNA
Bromide SCHEMBL11567156 0.81 MEN1 (0.48) NPSR1ALDH1A1MEN1KMT2AMAPT
Bromide SCHEMBL11558192 0.80 MEN1 (0.45) NPSR1ALDH1A1MEN1KMT2ALMNA
Bromide SCHEMBL11561016 0.79 MEN1 (0.44) NPSR1ALDH1A1MEN1KMT2ALMNA
Bromide SCHEMBL11567035 0.77 MEN1 (0.51) NPSR1ALDH1A1MEN1KMT2AMAPT
Bromide SCHEMBL11565948 0.77 NPSR1 (0.47) NPSR1ALDH1A1MEN1KMT2AKDM4E
Bromide SCHEMBL11564109 0.77 ALDH1A1 (0.47) NPSR1ALDH1A1MEN1KMT2AMAPT
SCHEMBL2571298 0.76 ADRA1D (0.42) ALDH1A1KMT2AMAPTKDM4EHSD17B10
Bromide SCHEMBL11562342 0.70 HTT (0.50) ALDH1A1MEN1KMT2AMAPTKDM4E

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-4151280-A ANTIALLERGENS ROUSSEL UCLAF (FR) 1979-04-24 — — US disclosed
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