Bromide

Bromide

SCHEMBL28574305

Br.C=CC1CCN(CC)CC1

nearest known ligand 0.41

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 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
HSD11B1 P28845 1/20 0.32
HRH3 Q9Y5N1 3/20 0.32
KMT2A Q03164 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL28294590 0.98 SMN1; SMN2 (0.42) SMN1; SMN2HSD11B1HRH3KMT2AOPRM1
SCHEMBL24235260 0.84
SCHEMBL24219259 0.80 DRD2 (0.43) SMN1; SMN2
SCHEMBL7147099 0.76 SMN1; SMN2 (0.43) SMN1; SMN2HSD11B1HRH3KMT2AKDM4E
SCHEMBL24243286 0.76 OPRD1 (0.38) HRH3OPRM1OPRD1KDM4E
SCHEMBL3956130 0.74 SMN1; SMN2 (0.47) SMN1; SMN2HSD11B1HRH3
SCHEMBL28227587 0.74
SCHEMBL20801730 0.74 PIK3CD (0.39) SMN1; SMN2HRH3KDM4E
SCHEMBL24235265 0.73
SCHEMBL21088308 0.73 SIGMAR1 (0.38) OPRM1OPRD1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110098426-B Polymer electrolyte fiber membrane, preparation method thereof and all-solid-state lithium ion battery 比亚迪股份有限公司 2022-03-15 CN disclosed
CN-110093054-B Cross-linked copolymer, polymer electrolyte, preparation methods of cross-linked copolymer and polymer electrolyte, and all-solid-state lithium ion battery 比亚迪股份有限公司 2021-06-18 CN disclosed