Bromide

Bromide

SCHEMBL2534726

O=[N+]([O-])c1ccc(Cn2cc[n+](Cc3ccc([N+](=O)[O-])cc3)c2)cc1.[Br-]

nearest known ligand 0.61

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 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.61
KMT2A Q03164 5/20 0.61
MAPT P10636 3/20 0.61
POLB P06746 2/20 0.51
ATM Q13315 1/20 0.51
LMNA P02545 3/20 0.50
CYP19A1 P11511 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
DBH P09172 1/20 0.42
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
KCNJ1 P48048 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
RAB9A P51151 1/20 0.40
P2RX4 Q99571 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 SCHEMBL2529292 0.77 NPC1 (0.45) MEN1KMT2AMAPTCYP19A1DBH
Bromide SCHEMBL2530194 0.77 CYP19A1 (0.44) MEN1KMT2AMAPTLMNACYP19A1
Bromide SCHEMBL2531327 0.77 MEN1 (0.37) MEN1KMT2AMAPT
Bromide SCHEMBL2526025 0.77 MEN1 (0.54) MEN1KMT2AMAPTPOLBATM
Bromide SCHEMBL1046638 0.77 MEN1 (0.50) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL10326004 0.77 MAPT (0.47) MEN1KMT2AMAPTPOLBLMNA
SCHEMBL21841998 0.75 CHKA (0.47) MEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL2533086 0.75 CYP2A6 (0.46) MEN1KMT2AMAPTATMCYP19A1
Bromide SCHEMBL15391642 0.75 MEN1 (0.50) MEN1KMT2AMAPTPOLBATM
SCHEMBL12220235 0.75 MEN1 (0.52) MEN1KMT2AMAPTPOLBATM

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-8632914-B2 Triazolium and imidazolium salts and uses thereof UNIVERSITY HEALTH NETWORK (CA) 2014-01-21 US disclosed
US-20110257235-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF UNIVERSITY HEALTH NETWORK (CA) 2011-10-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110257235-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF ARG2, ARG1, CIT MEN1 3327/4885KMT2A 3456/4885MAPT 4065/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.