Bromide

Bromide

SCHEMBL5077205

CCCCCCCCCCCCCCCCCCCCn1cc[n+](C)c1C.[Br-]

nearest known ligand 0.54

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
ACHE known ✓ P22303 2/20 0.40
CA1 P00915 5/20 0.54
CA2 P00918 5/20 0.54
KMT2A Q03164 4/20 0.54
MEN1 O00255 3/20 0.54
EEF2K O00418 2/20 0.54
EEF2 P13639 2/20 0.54
PLK4 O00444 1/20 0.54
JAK2 O60674 1/20 0.54
EGFR P00533 1/20 0.54
TYK2 P29597 1/20 0.54
FLT3 P36888 1/20 0.54
BLM P54132 1/20 0.54
ITK Q08881 1/20 0.54
PIM2 Q9P1W9 1/20 0.54
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
HTT P42858 4/20 0.50
HSP90AA1 P07900 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50

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 SCHEMBL5077134 1.00 CA1 (0.54) CA1CA2KMT2AMEN1EEF2K
Bromide SCHEMBL15329259 1.00 CA1 (0.54) CA1CA2KMT2AMEN1EEF2K
Bromide SCHEMBL1330856 1.00 CA1 (0.54) CA1CA2KMT2AMEN1EEF2K
Bromide SCHEMBL1330667 1.00 CA1 (0.54) CA1CA2KMT2AMEN1EEF2K
Bromide SCHEMBL15329023 1.00 CA1 (0.54) CA1CA2KMT2AMEN1EEF2K
Bromide SCHEMBL707781 1.00 CA1 (0.54) CA1CA2KMT2AMEN1EEF2K
SCHEMBL5287245 0.98 KMT2A (0.55) CA1CA2KMT2AMEN1EEF2K
SCHEMBL1501428 0.98 KMT2A (0.55) CA1CA2KMT2AMEN1EEF2K
SCHEMBL1826845 0.98 KMT2A (0.55) CA1CA2KMT2AMEN1EEF2K
SCHEMBL372335 0.98 KMT2A (0.55) CA1CA2KMT2AMEN1EEF2K

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-1697465-B1 POLYMER NANOCOMPOSITES AND METHODS FOR THEIR PREPARATION GEN ELECTRIC (US) 2008-02-13 EP disclosed
EP-1697465-A2 POLYMER NANOCOMPOSITES AND METHODS FOR THEIR PREPARATION GENERAL ELECTRIC COMPANY (US) 2006-09-06 EP disclosed
WO-2005061623-A2 POLYMER NANOCOMPOSITES AND METHODS FOR THEIR PREPARATION GENERAL ELECTRIC COMPANY (US) 2005-07-07 WO disclosed
US-20050137310-A1 Polymer nanocomposites and methods for their preparation CITIBANK, N.A., AS COLLATERAL AGENT 2005-06-23 US disclosed