Bromide

Bromide

SCHEMBL3385665

[Br-].[Br-].[Br-].[Zr+3]C1c2ccccc2-c2ccccc21

nearest known ligand 0.50

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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 3/20 0.35
CHRM2 known ✓ P08172 1/20 0.35
CHRM1 known ✓ P11229 1/20 0.35
OPRM1 known ✓ P35372 1/20 0.35
GPR3 P46089 2/20 0.44
HTR2A P28223 2/20 0.44
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
NCOR2 Q9Y618 1/20 0.38
POLB P06746 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
BCHE P06276 2/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35

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
Hydrochloric Acid SCHEMBL3384914 0.94 GPR3 (0.44) GPR3HTR2AHDAC3HDAC4HDAC7
Fluoride Ion SCHEMBL3384056 0.94 GPR3 (0.44) GPR3HTR2AHDAC3HDAC4HDAC7
Iodide SCHEMBL3385389 0.94 GPR3 (0.44) GPR3HTR2AHDAC3HDAC4HDAC7
Hydrochloric Acid SCHEMBL3196824 0.76 S100A4 (0.41) GPR3HTR2ACHRM2HTR1AADRA2A
Hydrochloric Acid SCHEMBL3206319 0.76 CYP1A2 (0.43) GPR3HTR2AHDAC3HDAC4HDAC7
Hydrochloric Acid SCHEMBL3201491 0.76 GPR3 (0.32) GPR3HTR2ACYP19A1
Hydrochloric Acid SCHEMBL5345923 0.73 MYC (0.39) GPR3HTR2AACHEKMT2AMEN1
Bromide SCHEMBL3383748 0.73 GPR3 (0.46) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL29950614 0.71 GPR3 (0.50) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL524603 0.71 GPR3 (0.50) GPR3HTR2AHDAC3HDAC4HDAC7

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-7709586-B2 Olefin polymerization catalyst and olefin polymerization process using the same DAELIM INDUSTRIAL CO., LTD. (KR) 2010-05-04 US disclosed
US-20070142221-A1 Olefin polymerization catalyst and olefin polymerization process using the same DAELIM INDUSTRIAL CO., LTD. 2007-06-21 US disclosed