Bromide

Bromide

SCHEMBL29732962

Br.BrBr.C1CCC2=NCCCN2CC1

nearest known ligand 0.88

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 9)

geneUniProtsupporting neighboursconfidence
▸ ACHE known ✓ P22303 8/20 0.35
▸ SIGMAR1 known ✓ Q99720 1/20 0.35
▸ INMT O95050 4/20 0.88
▸ USP2 O75604 2/20 0.88
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ NOS3 P29474 3/20 0.32
▸ NOS1 P29475 3/20 0.32
▸ NOS2 P35228 3/20 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
Bromide SCHEMBL8469764 0.96 INMT (0.95) INMTUSP2ACHESIGMAR1SMN1; SMN2
Bromide SCHEMBL14761484 0.96 INMT (0.95) INMTUSP2ACHESIGMAR1SMN1; SMN2
Bromide SCHEMBL29980319 0.94 INMT (0.91) INMTUSP2ACHESIGMAR1SMN1; SMN2
SCHEMBL2734323 0.94 INMT (1.00) INMTUSP2ACHESMN1; SMN2TDP1
SCHEMBL10601682 0.94 INMT (1.00) INMTUSP2ACHESMN1; SMN2TDP1
SCHEMBL3047 0.94 INMT (1.00) INMTUSP2ACHESMN1; SMN2TDP1
SCHEMBL17417853 0.94 INMT (1.00) INMTUSP2ACHESMN1; SMN2TDP1
SCHEMBL16583523 0.94 INMT (1.00) INMTUSP2ACHESMN1; SMN2TDP1
Bromide SCHEMBL18093523 0.92 INMT (0.88) INMTUSP2ACHESIGMAR1SMN1; SMN2
Iodide SCHEMBL23365018 0.91 INMT (0.95) INMTUSP2ACHESIGMAR1SMN1; SMN2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4267591-A2 ORGANOMETALLIC COMPOUNDS Umicore AG & Co. KG (DE) 2023-11-01 — — EP claimed
CN-116802187-A Organometallic compounds 优米科尔股份公司及两合公司 2023-09-22 — — CN claimed
WO-2022136049-A2 ORGANOMETALLIC COMPOUNDS UMICORE AG & CO. KG (DE) 2022-06-30 — — WO claimed
CN-112930340-B New synthetic method of piperazinyl-ethoxy-bromophenyl derivatives and their use in the production of compounds containing them 法国施维雅药厂 2025-01-07 — — CN disclosed
CN-119053608-A Novel compound, conjugated polymer, method for producing same, composition for film formation, organic thin film, and organic semiconductor element 东曹株式会社 2024-11-29 — — CN disclosed
CN-116847837-A Improved synthesis of CRAC channel inhibitors 钙医学公司 2023-10-03 — — CN disclosed
CN-116802187-A Organometallic compounds 优米科尔股份公司及两合公司 2023-09-22 — — CN disclosed
EP-4243813-A1 IMPROVED SYNTHESIS OF CRAC CHANNEL INHIBITORS Calcimedica, Inc. (US) 2023-09-20 — — EP disclosed
CN-116057032-A Process for preparing and purifying environmentally compatible detergents 武田药品工业株式会社 2023-05-02 — — CN disclosed
WO-2022101654-A1 IMPROVED SYNTHESIS OF CRAC CHANNEL INHIBITORS CALCIMEDICA, INC. (US) 2022-05-19 — — WO disclosed
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