Bromide

Bromide

SCHEMBL2535574

Brc1ccccc1Cn1cc[n+](Cc2ccccc2Br)c1.[Br-]

nearest known ligand 0.37

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 16)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.33
CYP2A13 Q16696 1/20 0.37
CYP19A1 P11511 1/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
RECQL P46063 2/20 0.35
BCHE P06276 2/20 0.33
MAPT P10636 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
ATM Q13315 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
IDO1 P14902 1/20 0.33

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
SCHEMBL13319087 0.74 MAPT (0.43) CYP19A1KMT2AMEN1RECQLMAPT
SCHEMBL21083236 0.74 POLB (0.50) KMT2AMEN1MAPTALDH1A1TSHR
SCHEMBL28239176 0.72 CYP2A13 (0.48) CYP2A13CYP19A1RECQLTAAR1ATM
SCHEMBL15179014 0.71 MEN1 (0.36) KMT2AMEN1RECQLBCHEMAPT
Bromide SCHEMBL1046638 0.70 MEN1 (0.50) CYP19A1KMT2AMEN1RECQLMAPT
SCHEMBL20622751 0.70 CHKA (0.39) KMT2AMEN1RECQLMAPTTSHR
Bromide SCHEMBL2532404 0.70 MEN1 (0.44) CYP19A1KMT2AMEN1RECQLMAPT
Bromide SCHEMBL2532407 0.70 MEN1 (0.44) CYP19A1KMT2AMEN1RECQLMAPT
SCHEMBL1044026 0.68 MAPT (0.48) CYP19A1KMT2AMEN1RECQLMAPT
Bromide SCHEMBL2530194 0.68 CYP19A1 (0.44) CYP19A1KMT2AMEN1BCHEMAPT

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 ACHE 2517/4885CYP2A13 2901/4885CYP19A1 3960/4885

“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.