Bromide

Bromide

SCHEMBL11310366

CN(/C=C/c1sc2cc(N)ccc2[n+]1C)c1ccccc1.[Br-]

nearest known ligand 0.44

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
▸ INSR P06213 12/20 0.44
▸ ADRB2 P07550 2/20 0.39
▸ RAB9A P51151 4/20 0.38
▸ HTT P42858 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ NSD2 O96028 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ADRB1 P08588 1/20 0.36
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ MITF O75030 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ AKT1 P31749 1/20 0.34
▸ AKT2 P31751 1/20 0.34

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 SCHEMBL11310368 1.00 INSR (0.44) INSRADRB2RAB9AHTTPOLB
SCHEMBL13646762 0.84 INSR (0.47) INSRRAB9AHTTPOLBNSD2
SCHEMBL10971186 0.83 INSR (0.59) INSRADRB2RAB9AHTTPOLB
SCHEMBL10971188 0.83 INSR (0.59) INSRADRB2RAB9AHTTPOLB
Bromide SCHEMBL11311515 0.79 INSR (0.39) INSRADRB2RAB9AHTTPOLB
Bromide SCHEMBL10974485 0.74 ALDH1A1 (0.43) INSRADRB2RAB9AHTTPOLB
SCHEMBL10974237 0.70 INSR (0.46) INSRADRB2RAB9AHTTPOLB
SCHEMBL10974234 0.70 INSR (0.46) INSRADRB2RAB9AHTTPOLB
Hydrochloric Acid SCHEMBL11515189 0.69 INSR (0.59) INSRADRB2RAB9AHTTPOLB
Hydrochloric Acid SCHEMBL11515186 0.69 INSR (0.59) INSRADRB2RAB9AHTTPOLB

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-4306016-A HETEROCYCLIC CYANINE DYE-LIKE NUCLEATING AGENTS EASTMAN KODAK COMPANY (US) 1981-12-15 — — US disclosed
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