Bromide

Bromide

SCHEMBL1882341

CCCCCCCCCCCC(CCc1ccc(CC)cc1C(=O)O)[n+]1cc[nH]c1.[Br-]

nearest known ligand 0.40

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 13)

geneUniProtsupporting neighboursconfidence
▸ KAT8 Q9H7Z6 2/20 0.40
▸ PPARA Q07869 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ PPARG P37231 1/20 0.35
▸ SLC16A3 O15427 1/20 0.35
▸ RARB P10826 8/20 0.35
▸ RARA P10276 2/20 0.35
▸ RARG P13631 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MTOR P42345 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PLK1 P53350 5/20 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
Bromide SCHEMBL1880768 0.96 KAT8 (0.36) KAT8PPARAALDH1A1PPARGSLC16A3
Bromide SCHEMBL1885173 0.92 ALDH1A1 (0.35) KAT8PPARAALDH1A1PPARGSLC16A3
Iodide SCHEMBL1884517 0.76 CYSLTR2 (0.36) MEN1KMT2A
Bromide SCHEMBL1894117 0.76 SLC16A3 (0.37) KAT8PPARAALDH1A1SLC16A3RARB
SCHEMBL5292848 0.74 CSNK1E (0.39) MEN1KMT2A
SCHEMBL5287873 0.74 CSNK1E (0.39) MEN1KMT2A
SCHEMBL5815845 0.74 CSNK1E (0.39) MEN1KMT2A
SCHEMBL5818768 0.74 CSNK1E (0.39) MEN1KMT2A
SCHEMBL5300705 0.74 CSNK1E (0.39) MEN1KMT2A
SCHEMBL5283847 0.74 CSNK1E (0.39) MEN1KMT2A

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-9260397-B2 Salts comprising aryl-alkyl-substituted imidazolium and triazolium cations and the use thereof TECHNISCHE UNIVERSITAET DRESDEN (DE) 2016-02-16 — — US disclosed
US-20110105761-A1 Salts Comprising Aryl-Alkyl-Substituted Imidazolium and Triazolium Cations and the Use Thereof TECHNISCHE UNIVERSITAET DRESDEN (DE) 2011-05-05 — — 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-20110105761-A1 Salts Comprising Aryl-Alkyl-Substituted Imidazolium and Triazolium Cations and the Use Thereof RDX, HAX1, CHRM2 KAT8 1305/4885PPARA 3709/4885ALDH1A1 2684/4885

“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.

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