Bromide

Bromide

SCHEMBL14779146

Br.CN1CN(CCCCCCCCCCO)c2ccccc21

nearest known ligand 0.37

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
▸ CHRM2 known ✓ P08172 1/20 0.32
▸ HTR1A known ✓ P08908 1/20 0.32
▸ ADRA2A known ✓ P08913 1/20 0.32
▸ ADRA2B known ✓ P18089 1/20 0.32
▸ ADRA2C known ✓ P18825 1/20 0.32
▸ SLC6A2 known ✓ P23975 1/20 0.32
▸ SLC6A4 known ✓ P31645 1/20 0.32
▸ ADRA1A known ✓ P35348 1/20 0.32
▸ SLC6A3 known ✓ Q01959 1/20 0.32
▸ SIGMAR1 known ✓ Q99720 1/20 0.32
▸ CES1 P23141 2/20 0.36
▸ CDC25A P30304 1/20 0.36
▸ MPO P05164 2/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 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
Iodide SCHEMBL14778471 0.97 CES1 (0.36) CES1CDC25AMPOALDH1A1KDM4E
Iodide SCHEMBL14779129 0.97 CES1 (0.36) CES1CDC25AMPOALDH1A1KDM4E
Hydrochloric Acid SCHEMBL14777819 0.97 CES1 (0.36) CES1CDC25AMPOALDH1A1KDM4E
Iodide SCHEMBL14778346 0.97 CES1 (0.36) CES1CDC25AMPOALDH1A1KDM4E
Hydrochloric Acid SCHEMBL14778468 0.97 CES1 (0.36) CES1CDC25AMPOALDH1A1KDM4E
Iodide SCHEMBL14777829 0.95 ALDH1A1 (0.35) CES1CDC25AMPOALDH1A1KDM4E
Hydrochloric Acid SCHEMBL14777891 0.95 ALDH1A1 (0.35) CES1CDC25AMPOALDH1A1KDM4E
Bromide SCHEMBL14777636 0.86 ALDH1A1 (0.38) CES1ALDH1A1KDM4EGAAMAPT
Bromide SCHEMBL14777972 0.85 ALDH1A1 (0.36) CES1CDC25AMPOALDH1A1KDM4E
Bromide SCHEMBL14778180 0.85 ALDH1A1 (0.36) CES1CDC25AMPOALDH1A1KDM4E

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-8658842-B2 Process for producing ethylene glycol catalyzed by ionic liquid INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2014-02-25 — — US disclosed
US-20130072727-A1 PROCESS FOR PRODUCING ETHYLENE GLYCOL CATALYZED BY IONIC LIQUID INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2013-03-21 — — 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-20130072727-A1 PROCESS FOR PRODUCING ETHYLENE GLYCOL CATALYZED BY IONIC LIQUID AGL, ALKBH3, ELL CHRM2 2537/4885HTR1A 4213/4885ADRA2A 4793/4885

“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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