Bromide

Bromide

SCHEMBL6543728

Br.CCOc1cc2c(cc1C(=O)NC)C(=N)N(CC(=O)c1ccc(C(=O)O)c(C(C)(C)C)c1)C2

nearest known ligand 0.43

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 15)

geneUniProtsupporting neighboursconfidence
F2R P25116 6/20 0.43
MAPT P10636 3/20 0.40
KDM4E B2RXH2 2/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.36
CREBBP Q92793 3/20 0.33
LMNA P02545 2/20 0.32
RXRA P19793 1/20 0.32
HNF4A P41235 1/20 0.32
PLK1 P53350 1/20 0.32
EPHX2 P34913 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 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
Hydrochloric Acid SCHEMBL1730994 0.98 F2R (0.44) F2RMAPTKDM4ERAB9ANPC1
Bromide SCHEMBL1731059 0.94 F2R (0.43) F2RMAPTKDM4ERAB9ANPC1
Bromide SCHEMBL1729267 0.92 F2R (0.42) F2RMAPTKDM4ERAB9ANPC1
Bromide SCHEMBL1731936 0.91 F2R (0.43) F2RMAPTKDM4ERAB9ANPC1
Bromide SCHEMBL1730898 0.91 F2R (0.45) F2RMAPTKDM4ERAB9ANPC1
Bromide SCHEMBL1729696 0.90 F2R (0.41) F2RMAPTKDM4ERAB9ANPC1
Bromide SCHEMBL5490703 0.90 F2R (0.43) F2RMAPTKDM4ERAB9ANPC1
Bromide SCHEMBL5486656 0.90 F2R (0.48) F2RMAPTKDM4ERAB9ANPC1
Bromide SCHEMBL1730902 0.90 F2R (0.41) F2RMAPTKDM4ERAB9ANPC1
Bromide SCHEMBL5481790 0.90 F2R (0.41) F2RMAPTKDM4ERAB9ANPC1

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