Bromide

Bromide

SCHEMBL1882333

Br.CCc1cn(-c2ccccc2)nn1

nearest known ligand 0.66

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 14)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 3/20 0.66
▸ L3MBTL1 Q9Y468 2/20 0.66
▸ MAOA P21397 1/20 0.66
▸ DRD2 P14416 3/20 0.55
▸ DRD4 P21917 3/20 0.55
▸ DRD3 P35462 3/20 0.55
▸ NPC1 O15118 1/20 0.52
▸ CD74 P04233 1/20 0.51
▸ MIF P14174 1/20 0.51
▸ GLA P06280 1/20 0.50
▸ POLB P06746 1/20 0.49
▸ HDAC8 Q9BY41 1/20 0.49
▸ KDM1A O60341 1/20 0.49
▸ P2RX7 Q99572 1/20 0.49

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
SCHEMBL3777938 0.98 NOTUM (0.68) NOTUML3MBTL1MAOADRD2DRD4
Bromide SCHEMBL1894577 0.86 NOTUM (0.62) NOTUML3MBTL1MAOADRD2DRD4
SCHEMBL12601113 0.84 NOTUM (0.64) NOTUML3MBTL1MAOADRD2DRD4
Bromide SCHEMBL1886330 0.82 MIF (0.71) NOTUML3MBTL1MAOADRD2DRD4
SCHEMBL15729971 0.82 MIF (0.64) NOTUML3MBTL1MAOADRD2DRD4
SCHEMBL20468184 0.81 NOTUM (0.72) NOTUML3MBTL1MIFPOLBP2RX7
Bromide SCHEMBL1883955 0.80 MIF (0.69) NOTUML3MBTL1MAOADRD2DRD4
Bromide SCHEMBL1880796 0.80 MIF (0.69) NOTUML3MBTL1MAOADRD2DRD4
Bromide SCHEMBL1880908 0.80 MIF (0.69) NOTUML3MBTL1MAOADRD2DRD4
Bromide SCHEMBL1890839 0.80 MIF (0.69) NOTUML3MBTL1MAOADRD2DRD4

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 4 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
EP-2254871-A1 SALTS COMPRISING ARYL-ALKYL-SUBSTITUTED IMIDAZOLIUM AND TRIAZOLIUM CATIONS AS IONIC FLUIDS Technische Universität Dresden (DE) 2010-12-01 — — EP disclosed
WO-2009095012-A1 SALTS COMPRISING ARYL-ALKYL-SUBSTITUTED IMIDAZOLIUM AND TRIAZOLIUM CATIONS AND THE USE THEREOF Technische Universität Dresden (DE) 2009-08-06 — — WO 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 NOTUM 960/4885L3MBTL1 2900/4885MAOA 1885/4885

“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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