Bromide

Bromide

SCHEMBL3936424

CN(N=Cc1cc[n+](CCCCCCn2cc[n+](CCCCn3ccnc3)c2)cc1)c1ccccc1.[Br-].[Br-]

nearest known ligand 0.39

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 11)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 6/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ CYP19A1 P11511 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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 SCHEMBL3936422 1.00 TBXAS1 (0.36) TBXAS1MEN1KMT2ALMNAMAPK1
SCHEMBL4583949 0.99 TBXAS1 (0.37) TBXAS1MEN1KMT2ALMNAMAPK1
SCHEMBL4583954 0.99 TBXAS1 (0.37) TBXAS1MEN1KMT2ALMNAMAPK1
SCHEMBL14386087 0.93 TBXAS1 (0.41) TBXAS1MEN1KMT2ALMNAMAPK1
SCHEMBL14386055 0.91 MAPT (0.37) MEN1KMT2ALMNAMAPK1ALDH1A1
SCHEMBL5326765 0.91 MAPT (0.37) MEN1KMT2ALMNAMAPK1ALDH1A1
SCHEMBL5324636 0.91 MAPT (0.37) MEN1KMT2ALMNAMAPK1ALDH1A1
SCHEMBL13717124 0.89 MAPT (0.36) MEN1KMT2ALMNAMAPK1ALDH1A1
Bromide SCHEMBL3930970 0.88 MEN1 (0.36) TBXAS1MEN1KMT2ALMNAMAPK1
Bromide SCHEMBL3929432 0.88 TBXAS1 (0.36) TBXAS1MEN1KMT2ALMNAMAPK1

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-7569079-B2 Polycationic monochromophoric hydrazone compounds, dye compositions comprising such polycationic compounds and dyeing process using them L'OREAL S.A. (FR) 2009-08-04 — — US disclosed
US-20080263785-A1 Polycationic monochromophoric hydrazone compounds, dye compositions comprising such polycationic compounds and dyeing process using them L'OREAL S.A. (FR) 2008-10-30 — — 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-20080263785-A1 Polycationic monochromophoric hydrazone compounds, dye compositions comprising such polycationic compounds and dyeing process using them KRT18, CKMT1A; CKMT1B, XRCC5 TBXAS1 4801/4885MEN1 2823/4885KMT2A 459/4885

“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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