Bromide

Bromide

SCHEMBL28055010

Br.CN(C)c1cccc(-c2ccccc2)c1-c1ccccc1.P

nearest known ligand 0.50

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 20)

geneUniProtsupporting neighboursconfidence
HTR1A known ✓ P08908 1/20 0.34
ALDH1A1 P00352 6/20 0.50
MAPT P10636 3/20 0.50
MAPK1 P28482 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
NSD2 O96028 1/20 0.50
EGFR P00533 1/20 0.50
LMNA P02545 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PDK2 Q15119 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
PGR P06401 1/20 0.36
HTR7 P34969 3/20 0.36
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
HNF4A P41235 1/20 0.35

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
SCHEMBL7915840 0.96 ALDH1A1 (0.53) ALDH1A1MAPTMAPK1L3MBTL1NSD2
SCHEMBL6724502 0.84 ALDH1A1 (0.40) ALDH1A1MAPTMAPK1L3MBTL1NSD2
SCHEMBL28285937 0.83 MAPT (0.50) ALDH1A1MAPTMAPK1L3MBTL1NSD2
SCHEMBL29433183 0.79 ALDH1A1 (0.45) ALDH1A1MAPTMAPK1L3MBTL1NSD2
SCHEMBL1254512 0.79 ALDH1A1 (0.45) ALDH1A1MAPTMAPK1L3MBTL1NSD2
Phosphine SCHEMBL27890176 0.78 KCNN4 (0.42) ALDH1A1MAPTMAPK1L3MBTL1NSD2
SCHEMBL27517786 0.77 ALDH1A1 (0.44) ALDH1A1MAPTMAPK1L3MBTL1NSD2
SCHEMBL30763243 0.77 ALDH1A1 (0.44) ALDH1A1MAPTMAPK1L3MBTL1NSD2
SCHEMBL27516508 0.77 ALDH1A1 (0.44) ALDH1A1MAPTMAPK1L3MBTL1NSD2
Hydrochloric Acid SCHEMBL2866856 0.77 ALDH1A1 (0.44) ALDH1A1MAPTMAPK1L3MBTL1NSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105400403-A Colored coating and artificial leather MILLIKEN & CO 2016-03-16 CN disclosed
CN-105400404-A Colored coating and artificial leather comprising a colorant complex MILLIKEN & CO 2016-03-16 CN disclosed