Bromide

Bromide

SCHEMBL6544527

Br.CCCCC(c1cc(C(=O)CN2Cc3ccc(C4CC4)nc3C2=N)ccc1OC)S(=O)(=O)O

nearest known ligand 0.35

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 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PDE4B Q07343 4/20 0.31
PDE4D Q08499 4/20 0.31
PDE4A P27815 2/20 0.31
PDE4C Q08493 2/20 0.31
F2R P25116 1/20 0.30

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 SCHEMBL6544040 0.90 F2R (0.32) MAPTKDM4ENPC1RAB9AF2R
Bromide SCHEMBL1730266 0.76 KDM4E (0.34) MAPTKDM4ENPC1RAB9AF2R
SCHEMBL27506130 0.75 HSP90AA1 (0.42) MAPTKDM4ENPC1RAB9AMEN1
Bromide SCHEMBL1729690 0.74 F2R (0.35) MAPTKDM4ENPC1RAB9AF2R
Bromide SCHEMBL1731929 0.72 F2R (0.36) MAPTKDM4ENPC1RAB9AF2R
Bromide SCHEMBL1731017 0.72 KDM4E (0.34) MAPTKDM4ENPC1RAB9AF2R
Bromide SCHEMBL1731020 0.72 F2R (0.41) MAPTKDM4ENPC1RAB9AF2R
Bromide SCHEMBL1730770 0.72 F2R (0.54) MAPTKDM4ENPC1RAB9AF2R
Bromide SCHEMBL1732483 0.72 PDE4B (0.34) MAPTKDM4ENPC1RAB9APDE4B
Bromide SCHEMBL6544436 0.71 KDM4E (0.35) MAPTKDM4ENPC1RAB9A

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
EP-1391451-A1 2-IMINOPYRROLIDINE DERIVATES Eisai Co., Ltd. (JP) 2004-02-25 EP disclosed