Bromide

Bromide

SCHEMBL11490662

COC(=O)C[n+]1cccc(Oc2ccccc2)c1.[Br-]

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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
ALDH1A1 P00352 5/20 0.44
KMT2A Q03164 4/20 0.44
KDM4E B2RXH2 2/20 0.44
PABPC1 P11940 2/20 0.44
ATM Q13315 1/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
APOBEC3A P31941 1/20 0.44
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
GLA P06280 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 2/20 0.42
HPGD P15428 2/20 0.42
LMNA P02545 2/20 0.41
BCHE P06276 1/20 0.39
HSP90AA1 P07900 1/20 0.39
CYP1A2 P05177 1/20 0.39
ADRB2 P07550 1/20 0.39

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 SCHEMBL11489914 0.86 GLA (0.53) ALDH1A1KMT2AKDM4EPABPC1ATM
Hydrochloric Acid SCHEMBL11490843 0.83 GLA (0.50) ALDH1A1KMT2AKDM4EPABPC1ATM
Bromide SCHEMBL9080240 0.75 KMT2A (0.53) ALDH1A1KMT2AKDM4EPABPC1MEN1
SCHEMBL12534300 0.73 KMT2A (0.50) ALDH1A1KMT2AKDM4EPABPC1MEN1
Bromide SCHEMBL26128657 0.72 HTT (0.43) ALDH1A1KMT2AKDM4EPABPC1ATM
Diphenylether SCHEMBL27690785 0.72 HPGD (0.53) ALDH1A1SMN1; SMN2HPGDCYP1A2CYP2C9
Hydrochloric Acid SCHEMBL5848674 0.71 HSP90AA1 (0.50) ALDH1A1KMT2AKDM4EMEN1USP2
Bromide SCHEMBL11484628 0.71 GLA (0.44) ALDH1A1KMT2AKDM4EPABPC1ATM
Bromide SCHEMBL22366434 0.71 LTA4H (0.46) PABPC1BCHEEIF4HCTDSP1
SCHEMBL26415684 0.71 HTT (0.41) ALDH1A1KMT2AKDM4EPABPC1ATM

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
US-4187311-A TREATMENT OF SENILITY AND REVERSAL OF AMNESIA WARNER-LAMBERT COMPANY (US) 1980-02-05 US claimed
US-4187311-A TREATMENT OF SENILITY AND REVERSAL OF AMNESIA WARNER-LAMBERT COMPANY (US) 1980-02-05 US disclosed