Bromide

Bromide

SCHEMBL6544472

Br.CCCCc1cc(C(=O)CN2Cc3ccc(CC)nc3C2=N)cc(C(=O)O)c1OCC

nearest known ligand 0.33

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
F2R P25116 6/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
GABRA6 Q16445 1/20 0.31
GABRG1 Q8N1C3 1/20 0.31

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 SCHEMBL5488898 0.85 F2R (0.44) F2RKDM4EMAPTRAB9ANPC1
SCHEMBL1732238 0.84 F2R (0.44) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL1731389 0.80 F2R (0.39) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL1729844 0.79 F2R (0.43) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL1731794 0.77 F2R (0.37) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL1731367 0.77 F2R (0.37) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL6544809 0.77 F2R (0.37) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL5484959 0.77 F2R (0.41) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL1731075 0.76 F2R (0.41) F2RKDM4EMAPTRAB9ANPC1
Bromide SCHEMBL1729677 0.74 F2R (0.46) F2RKDM4EMAPTRAB9ANPC1

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