Bromide

Bromide

SCHEMBL10462008

Br.CCOC(=O)C1CCCN(Cc2ccccc2)C1

nearest known ligand 0.84

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 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.84
ATM Q13315 1/20 0.84
KDM4E B2RXH2 8/20 0.77
ALDH1A1 P00352 10/20 0.74
TDP1 Q9NUW8 2/20 0.72
SMN1; SMN2 Q16637 1/20 0.72
MAPK1 P28482 1/20 0.69
NPSR1 Q6W5P4 1/20 0.69
TSHR P16473 1/20 0.65
GAA P10253 1/20 0.65

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
SCHEMBL1946258 0.99 L3MBTL1 (0.86) L3MBTL1ATMKDM4EALDH1A1TDP1
Cadaverine Tartrate SCHEMBL27494555 0.92 L3MBTL1 (0.76) L3MBTL1ATMKDM4EALDH1A1TDP1
SCHEMBL14022760 0.91 L3MBTL1 (0.74) L3MBTL1ATMKDM4EALDH1A1TDP1
SCHEMBL1545229 0.91 L3MBTL1 (0.74) L3MBTL1ATMKDM4EALDH1A1TDP1
SCHEMBL8263564 0.91 L3MBTL1 (0.74) L3MBTL1ATMKDM4EALDH1A1TDP1
SCHEMBL8250801 0.89 ALDH1A1 (0.80) L3MBTL1ATMKDM4EALDH1A1TDP1
SCHEMBL3317577 0.89 L3MBTL1 (0.71) L3MBTL1ATMKDM4EALDH1A1SMN1; SMN2
SCHEMBL4850083 0.88 ALDH1A1 (0.78) L3MBTL1ATMKDM4EALDH1A1TDP1
SCHEMBL6183167 0.87 L3MBTL1 (0.69) L3MBTL1ATMKDM4EALDH1A1TDP1
SCHEMBL10016602 0.87 KDM4E (1.00) L3MBTL1ATMKDM4EALDH1A1TDP1

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-4950674-A Arylalkylheterocyclic amines,N-substituted by aryloxyalkyl group in a method for allergy treatment A. H. ROBINS COMPANY, INCORPORATED (US) 1990-08-21 US disclosed