4,4'-bis(methylsulfonyl)-2,2',5,5'-tetrachlorobiphenyl profile

4,4'-bis(methylsulfonyl)-2,2',5,5'-tetrachlorobiphenyl: metabolite of polychlorinated biphenyl cpds [Medical Subject Headings (MeSH), National Library of Medicine, extracted Dec-2023]

2,2',5,5'-tetrachloro-4,4'-bis(methylsulfonyl)biphenyl : An member of the class of biphenyls that is 2,2',5,5'-tetrachlorobiphenyl in which the 4 and 4' positions are substituted by methylsulfonyl groups. [Chemical Entities of Biological Interest (ChEBI), Hastings J, Owen G, Dekker A, Ennis M, Kale N, Muthukrishnan V, Turner S, Swainston N, Mendes P, Steinbeck C. (2016). ChEBI in 2016: Improved services and an expanding collection of metabolites. Nucleic Acids Res]

Cross-References

ID Source	ID
PubMed CID	115069
CHEBI ID	49809
MeSH ID	M0129971

Synonyms (17)

Synonym
bmstbp
4,4'-bis([h]methylsulfonyl)-2,2',5,5'-tetrachlorobiphenyl
1UTR
CHEBI:49809
4,4'-bis(methylsulfonyl)-2,2',5,5'-tetrachlorobiphenyl
66640-68-4
2,2',5,5'-tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl
2,2',5,5'-tetrachloro-4,4'-bis(methylsulfonyl)biphenyl
DB08373
1,1'-biphenyl, 2,2',5,5'-tetrachloro-4,4'-bis(methylsulfonyl)-
rx2c8qlh24 ,
unii-rx2c8qlh24
DTXSID60216807
4,4'-bis(methylsulfonyl)-2,2',5,5'-tetrachloro-biphenyl
4,4'-bis((h)methylsulfonyl)-2,2',5,5'-tetrachlorobiphenyl
Q27097588
PD004458

Drug Classes (3)

Class	Description
sulfone	An organosulfur compound having the structure RS(=O)2R (R =/= H).
biphenyls	Benzenoid aromatic compounds containing two phenyl or substituted-phenyl groups which are joined together by a single bond.
dichlorobenzene	Any member of the class of chlorobenzenes carrying two chloro groups at unspecified positions.
[compound class information is derived from Chemical Entities of Biological Interest (ChEBI), Hastings J, Owen G, Dekker A, Ennis M, Kale N, Muthukrishnan V, Turner S, Swainston N, Mendes P, Steinbeck C. (2016). ChEBI in 2016: Improved services and an expanding collection of metabolites. Nucleic Acids Res]

Protein Targets (2)

Activation Measurements

Protein	Taxonomy	Measurement	Average	Min (ref.)	Avg (ref.)	Max (ref.)	Bioassay(s)
Chain A, UTEROGLOBIN	Rattus norvegicus (Norway rat)	Kd	0.0100	0.0100	0.0100	0.0100	AID977611
Chain B, UTEROGLOBIN	Rattus norvegicus (Norway rat)	Kd	0.0100	0.0100	0.0100	0.0100	AID977611
[prepared from compound, protein, and bioassay information from National Library of Medicine (NLM), extracted Dec-2023]

Bioassays (2)

Assay ID	Title	Year	Journal	Article
AID977611	Experimentally measured binding affinity data (Kd) for protein-ligand complexes derived from PDB	1995	Nature structural biology, Nov, Volume: 2, Issue:11	Solution structure of a mammalian PCB-binding protein in complex with a PCB.
AID1811	Experimentally measured binding affinity data derived from PDB	1995	Nature structural biology, Nov, Volume: 2, Issue:11	Solution structure of a mammalian PCB-binding protein in complex with a PCB.
[information is prepared from bioassay data collected from National Library of Medicine (NLM), extracted Dec-2023]

Research

Studies (8)

Timeframe	Studies, This Drug (%)	All Drugs %
pre-1990	3 (37.50)	18.7374
1990's	5 (62.50)	18.2507
2000's	0 (0.00)	29.6817
2010's	0 (0.00)	24.3611
2020's	0 (0.00)	2.80
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Market Indicators

Research Demand Index: 12.17

According to the monthly volume, diversity, and competition of internet searches for this compound, as well the volume and growth of publications, there is estimated to be weak demand-to-supply ratio for research on this compound.

Metric	This Compound (vs All)
Research Demand Index	12.17 (24.57)
Research Supply Index	2.40 (2.92)
Research Growth Index	4.56 (4.65)
Search Engine Demand Index	0.00 (26.88)
Search Engine Supply Index	0.00 (0.95)

This Compound (12.17)

All Compounds (24.57)

Study Types

Publication Type	This drug (%)	All Drugs (%)
Trials	0 (0.00%)	5.53%
Reviews	0 (0.00%)	6.00%
Case Studies	0 (0.00%)	4.05%
Observational	0 (0.00%)	0.25%
Other	10 (100.00%)	84.16%
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Substance	Relationship Strength	Studies	Trials	Classes	Roles
dithiothreitol 1,4-dimercaptobutane-2,3-diol : A glycol that is butane-2,3-diol in which a hydrogen from each of the methyl groups is replaced by a thiol group.. 1,4-dithiothreitol : The threo-diastereomer of 1,4-dimercaptobutane-2,3-diol.	1.97	1	0	1,4-dimercaptobutane-2,3-diol; butanediols; dithiol; glycol; thiol	chelator; human metabolite; reducing agent

4,4'-bis(methylsulfonyl)-2,2',5,5'-tetrachlorobiphenyl

Description