Bromide

Bromide

SCHEMBL8613045

COc1ccc(C[N+](C)(C)C)cc1.[Br-]

nearest known ligand 0.52

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
IDO1 P14902 3/20 0.52
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
AGXT P21549 2/20 0.48
LTA4H P09960 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALOX15 P16050 2/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
ALOX12 P18054 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CHRNB2 P17787 1/20 0.45

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
SCHEMBL16187145 0.98 IDO1 (0.54) IDO1CA12CA1CA2CA7
SCHEMBL27500681 0.95 IDO1 (0.52) IDO1CA12CA1CA2CA7
SCHEMBL5675685 0.80 IDO1 (0.50) IDO1CA12CA1CA2CA7
SCHEMBL4797252 0.80 ALDH1A1 (0.68) ALDH1A1KDM4ETDP1TP53SMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL1455740 0.79 EGFR (0.44) CA1CA2ALDH1A1SMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL1455736 0.79 PKM (0.46) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL10527448 0.78 IDO1 (0.48) IDO1CA12CA1CA2CA7
SCHEMBL9479556 0.77 IDO1 (0.52) IDO1CA12CA1CA2CA7
SCHEMBL26497801 0.77 KDM4E (0.48) IDO1AGXTTAAR1ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL4795693 0.77 ALDH1A1 (0.74) ALDH1A1KDM4ETDP1TP53SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0518352-B1 Process for forming super high-contrast negative images and silver halide photographic material and developer being used therefor DAINIPPON INK & CHEMICALS (JP) 1998-04-22 EP disclosed
US-5460919-A Process of forming super high-contrast negative images and silver halide photographic material and developer being used therefor DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-10-24 US disclosed
US-5372911-A Support having one or more hydrophilic colloidal layers, at least one layer contains pyridinium salt or derivative, quinolinium salt or derivative, or isoquinolinium salt or derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 1994-12-13 US disclosed
EP-0518352-A1 Process for forming super high-contrast negative images and silver halide photographic material and developer being used therefor DAINIPPON INK AND CHEMICALS, INC. (JP) 1992-12-16 EP disclosed