Bromide

Bromide

SCHEMBL29109663

Br.CC1N(CCO)c2ccc3ccccc3c2C1(C)C

nearest known ligand 0.36

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
▸ ACHE known ✓ P22303 1/20 0.31
▸ KDM4E B2RXH2 4/20 0.36
▸ MAPT P10636 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.33
▸ GLA P06280 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ RCE1 Q9Y256 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ HRH3 Q9Y5N1 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ HTT P42858 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL15007793 0.99 KDM4E (0.37) KDM4EMAPTMEN1KMT2AMAPK1
Bromide SCHEMBL7046232 0.90 CNR2 (0.37) KDM4EMAPTMEN1KMT2AMAPK1
SCHEMBL7044297 0.88 CNR2 (0.38) KDM4EMAPTMEN1KMT2AMAPK1
Bromide SCHEMBL28382629 0.85 MAPT (0.40) KDM4EMAPTKMT2AALDH1A1GLA
Bromide SCHEMBL14958491 0.85 MAPT (0.40) KDM4EMAPTKMT2AALDH1A1GLA
Bromide SCHEMBL14958504 0.84 TLR8 (0.39) KDM4EMAPTMEN1KMT2AMAPK1
SCHEMBL1306089 0.83 MAPT (0.41) KDM4EMAPTKMT2AALDH1A1GLA
SCHEMBL28685784 0.83 ELANE (0.37) KDM4EMAPTMEN1KMT2AMAPK1
Iodide SCHEMBL28381275 0.82 MAPT (0.40) KDM4EMAPTKMT2AALDH1A1GLA
Bromide SCHEMBL14958495 0.82 HRH3 (0.33) KDM4EMAPTMEN1KMT2AMAPK1

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
CN-117092077-A Visual fluorescent test paper for detecting sulfur dioxide and derivatives thereof, and preparation method and application thereof 广东工业大学 2023-11-21 — — CN disclosed
CN-117024442-A Targeting lysosomes, pH activated SO 2 Fluorescent probe and preparation and application thereof 广东工业大学 2023-11-10 — — CN disclosed
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