Bromide

Bromide

SCHEMBL7128948

Br.Nc1nc(-c2ccccc2)cs1

nearest known ligand 0.96

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 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.96
CYP3A4 P08684 1/20 0.96
RAB9A P51151 8/20 0.88
MAPT P10636 8/20 0.88
NPC1 O15118 6/20 0.88
SMN1; SMN2 Q16637 5/20 0.88
MEN1 O00255 4/20 0.88
KMT2A Q03164 4/20 0.88
KDM4E B2RXH2 4/20 0.88
NFKB1 P19838 2/20 0.88
NFKB2 Q00653 2/20 0.88
RELA Q04206 2/20 0.88
LMNA P02545 1/20 0.88
LTA4H P09960 3/20 0.68
MKNK1 Q9BUB5 1/20 0.62
MKNK2 Q9HBH9 1/20 0.62
ALOX5 P09917 1/20 0.62
GFER P55789 2/20 0.61
AR P10275 1/20 0.61
HPGD P15428 1/20 0.59

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 SCHEMBL5325472 0.98 ALDH1A1 (1.00) ALDH1A1CYP3A4RAB9AMAPTNPC1
SCHEMBL44869 0.98 ALDH1A1 (1.00) ALDH1A1CYP3A4RAB9AMAPTNPC1
Hydrochloric Acid SCHEMBL5450269 0.94 ALDH1A1 (0.92) ALDH1A1CYP3A4RAB9AMAPTNPC1
SCHEMBL2907964 0.94 ALDH1A1 (1.00) ALDH1A1CYP3A4RAB9AMAPTNPC1
SCHEMBL11505502 0.87 ALDH1A1 (0.79) ALDH1A1CYP3A4RAB9AMAPTNPC1
SCHEMBL1771825 0.86 ALDH1A1 (0.79) ALDH1A1CYP3A4RAB9AMAPTNPC1
SCHEMBL1399840 0.84 ALDH1A1 (0.76) ALDH1A1CYP3A4RAB9AMAPTNPC1
SCHEMBL23610361 0.84 ALDH1A1 (0.83) ALDH1A1CYP3A4RAB9AMAPTNPC1
Iodide SCHEMBL5460208 0.84 RAB9A (0.87) ALDH1A1CYP3A4RAB9AMAPTNPC1
SCHEMBL6256294 0.83 RAB9A (1.00) ALDH1A1CYP3A4RAB9AMAPTNPC1

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-20030134859-A1 PPAR-gamma modulator SANKYO COMPANY, LIMITED (JP) 2003-07-17 US disclosed
EP-1277729-A1 PPAR (GAMMA) MODULATORS Sankyo Company, Limited (JP) 2003-01-22 EP 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-20030134859-A1 PPAR-gamma modulator PPARG, PPARA, PPARD ALDH1A1 583/4885CYP3A4 1516/4885RAB9A 1179/4885

“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.