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PubMed code 17197181

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Androgen receptor


(Homo sapiens (Human))		BDBM50201772
PNG
(2-(5,6-dichloro-1H-benzo[d]imidazol-2-yl)-1,1,1-tr...)
Show SMILES CC(C)C(O)(c1nc2cc(Cl)c(Cl)cc2[nH]1)C(F)(F)F |w:3.3|
Show InChI InChI=1S/C12H11Cl2F3N2O/c1-5(2)11(20,12(15,16)17)10-18-8-3-6(13)7(14)4-9(8)19-10/h3-5,20H,1-2H3,(H,18,19)
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Article
PubMed
n/an/a 2n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Binding affinity at androgen receptor expressed in COS cells by whole cell binding assay

Bioorg Med Chem Lett 17: 1784-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.045
BindingDB Entry DOI: 10.7270/Q2KW5FQJ
More data for this
Ligand-Target Pair
Androgen receptor


(Homo sapiens (Human))		BDBM50201773
PNG
(2-(5,6-dichloro-1H-benzo[d]imidazol-2-yl)-1,1,1-tr...)
Show SMILES OC(C=C)(c1nc2cc(Cl)c(Cl)cc2[nH]1)C(F)(F)F |w:1.0|
Show InChI InChI=1S/C11H7Cl2F3N2O/c1-2-10(19,11(14,15)16)9-17-7-3-5(12)6(13)4-8(7)18-9/h2-4,19H,1H2,(H,17,18)
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n/an/a 7n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Binding affinity at androgen receptor expressed in COS cells by whole cell binding assay

Bioorg Med Chem Lett 17: 1784-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.045
BindingDB Entry DOI: 10.7270/Q2KW5FQJ
More data for this
Ligand-Target Pair
Androgen receptor


(Homo sapiens (Human))		BDBM50201771
PNG
(2-(5,6-dichloro-1H-benzo[d]imidazol-2-yl)-3-(ethyl...)
Show SMILES CCSCC(O)(c1nc2cc(Cl)c(Cl)cc2[nH]1)C(F)(F)F |w:4.4|
Show InChI InChI=1S/C12H11Cl2F3N2OS/c1-2-21-5-11(20,12(15,16)17)10-18-8-3-6(13)7(14)4-9(8)19-10/h3-4,20H,2,5H2,1H3,(H,18,19)
PDB
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Article
PubMed
n/an/a 17n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Binding affinity at androgen receptor expressed in COS cells by whole cell binding assay

Bioorg Med Chem Lett 17: 1784-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.045
BindingDB Entry DOI: 10.7270/Q2KW5FQJ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%