Bromide

Bromide

SCHEMBL1732167

Br.CCOc1cc2c(cc1C(=O)NC)C(=N)N(CC(=O)c1cc(OC)c(OC(C)C(=O)O)c(C(C)(C)C)c1)C2

nearest known ligand 0.46

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 10)

geneUniProtsupporting neighboursconfidence
F2R P25116 16/20 0.46
KDM4E B2RXH2 3/20 0.36
RAB9A P51151 3/20 0.36
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 2/20 0.32
GLA P06280 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
SMN1; SMN2 Q16637 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 SCHEMBL1730620 0.92 F2R (0.51) F2RKDM4ERAB9AMAPTNPC1
SCHEMBL12151783 0.91 F2R (0.51) F2RKDM4ERAB9AMAPTNPC1
Bromide SCHEMBL5486569 0.90 F2R (0.49) F2RKDM4ERAB9AMAPTNPC1
Bromide SCHEMBL1728919 0.90 F2R (0.48) F2RKDM4ERAB9AMAPTNPC1
Bromide SCHEMBL1728702 0.89 F2R (0.54) F2RKDM4ERAB9AMAPTNPC1
SCHEMBL14449154 0.89 F2R (0.48) F2RKDM4ERAB9AMAPTNPC1
SCHEMBL1729455 0.89 F2R (0.42) F2RKDM4ERAB9AMAPTNPC1
SCHEMBL14449120 0.89 F2R (0.53) F2RKDM4ERAB9AMAPTNPC1
Bromide SCHEMBL1732780 0.88 F2R (0.48) F2RKDM4ERAB9AMAPTNPC1
Bromide SCHEMBL1731182 0.88 F2R (0.40) F2RKDM4ERAB9AMAPTNPC1

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-B1 2-IMINOPYRROLIDINE DERIVATES EISAI R&D MAN CO LTD (JP) 2011-11-23 EP disclosed