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PubMed code 19447610

Compile data set for download or QSAR
Found 39 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
Nociceptin receptor


(Homo sapiens (Human))		BDBM29986
PNG
(arylpyrazole, 31)
Show SMILES Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(c1-c1cnc(C)c(F)c1)-c1ncccc1Cl |r|
Show InChI InChI=1S/C21H22ClF2N5/c1-12-19(11-27-16-6-5-15(23)9-16)28-29(21-17(22)4-3-7-25-21)20(12)14-8-18(24)13(2)26-10-14/h3-4,7-8,10,15-16,27H,5-6,9,11H2,1-2H3/t15-,16+/m1/s1
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n/an/a 0.520n/a 0.310n/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29985
PNG
(arylpyrazole, 30)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1cnc(C)c(F)c1)-c1ncccc1Cl
Show InChI InChI=1S/C21H23ClFN5/c1-13-19(12-26-16-6-3-4-7-16)27-28(21-17(22)8-5-9-24-21)20(13)15-10-18(23)14(2)25-11-15/h5,8-11,16,26H,3-4,6-7,12H2,1-2H3
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n/an/a 1.10n/a 1.20n/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29983
PNG
(arylpyrazole, 28)
Show SMILES Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(c1-c1ccc(C)nc1)-c1ncccc1Cl |r|
Show InChI InChI=1S/C21H23ClFN5/c1-13-5-6-15(11-25-13)20-14(2)19(12-26-17-8-7-16(23)10-17)27-28(20)21-18(22)4-3-9-24-21/h3-6,9,11,16-17,26H,7-8,10,12H2,1-2H3/t16-,17+/m1/s1
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n/an/a 2.5n/a 1n/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29974
PNG
(arylpyrazole, 19)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(C)nc1)-c1ncccc1Cl
Show InChI InChI=1S/C21H24ClN5/c1-14-9-10-16(12-24-14)20-15(2)19(13-25-17-6-3-4-7-17)26-27(20)21-18(22)8-5-11-23-21/h5,8-12,17,25H,3-4,6-7,13H2,1-2H3
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n/an/a 4n/a 4.70n/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29981
PNG
(arylpyrazole, 26)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(C)nc1)-c1ncc(Cl)cc1Cl
Show InChI InChI=1S/C21H23Cl2N5/c1-13-7-8-15(10-24-13)20-14(2)19(12-25-17-5-3-4-6-17)27-28(20)21-18(23)9-16(22)11-26-21/h7-11,17,25H,3-6,12H2,1-2H3
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n/an/a 8.20n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29984
PNG
(arylpyrazole, 29)
Show SMILES Cc1c(CNC2CCC(F)(F)C2)nn(c1-c1ccc(C)nc1)-c1ncccc1Cl
Show InChI InChI=1S/C21H22ClF2N5/c1-13-5-6-15(11-26-13)19-14(2)18(12-27-16-7-8-21(23,24)10-16)28-29(19)20-17(22)4-3-9-25-20/h3-6,9,11,16,27H,7-8,10,12H2,1-2H3
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n/an/a 9.30n/a 4.5n/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29973
PNG
(arylpyrazole, 18)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(Cl)nc1)-c1ncccc1Cl
Show InChI InChI=1S/C20H21Cl2N5/c1-13-17(12-24-15-5-2-3-6-15)26-27(20-16(21)7-4-10-23-20)19(13)14-8-9-18(22)25-11-14/h4,7-11,15,24H,2-3,5-6,12H2,1H3
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n/an/a 11n/a 12n/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29982
PNG
(arylpyrazole, 27)
Show SMILES Cc1c(CNC2CCCC2F)nn(c1-c1ccc(C)nc1)-c1ncccc1Cl
Show InChI InChI=1S/C21H23ClFN5/c1-13-8-9-15(11-25-13)20-14(2)19(12-26-18-7-3-6-17(18)23)27-28(20)21-16(22)5-4-10-24-21/h4-5,8-11,17-18,26H,3,6-7,12H2,1-2H3
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n/an/a 11n/a 7.10n/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29977
PNG
(arylpyrazole, 22)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1cncc(C)c1)-c1ncccc1Cl
Show InChI InChI=1S/C21H24ClN5/c1-14-10-16(12-23-11-14)20-15(2)19(13-25-17-6-3-4-7-17)26-27(20)21-18(22)8-5-9-24-21/h5,8-12,17,25H,3-4,6-7,13H2,1-2H3
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n/an/a 13n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29960
PNG
(arylpyrazole, 1)
Show SMILES CC(C)NCc1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C20H20Cl3N3/c1-12(2)24-11-18-13(3)20(14-4-6-15(21)7-5-14)26(25-18)19-9-8-16(22)10-17(19)23/h4-10,12,24H,11H2,1-3H3
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n/an/a 23n/an/an/an/a7.422



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29968
PNG
(arylpyrazole, 13)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C22H22Cl3N3/c1-14-20(13-26-18-4-2-3-5-18)27-28(21-11-10-17(24)12-19(21)25)22(14)15-6-8-16(23)9-7-15/h6-12,18,26H,2-5,13H2,1H3
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n/an/a 23n/an/an/an/a7.422



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29968
PNG
(arylpyrazole, 13)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C22H22Cl3N3/c1-14-20(13-26-18-4-2-3-5-18)27-28(21-11-10-17(24)12-19(21)25)22(14)15-6-8-16(23)9-7-15/h6-12,18,26H,2-5,13H2,1H3
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n/an/a 28n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29978
PNG
(arylpyrazole, 23)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(C)nc1)-c1ncccc1C
Show InChI InChI=1S/C22H27N5/c1-15-7-6-12-23-22(15)27-21(18-11-10-16(2)24-13-18)17(3)20(26-27)14-25-19-8-4-5-9-19/h6-7,10-13,19,25H,4-5,8-9,14H2,1-3H3
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n/an/a 33n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29979
PNG
(arylpyrazole, 24)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(C)nc1)-c1ncccc1C(F)(F)F
Show InChI InChI=1S/C22H24F3N5/c1-14-9-10-16(12-27-14)20-15(2)19(13-28-17-6-3-4-7-17)29-30(20)21-18(22(23,24)25)8-5-11-26-21/h5,8-12,17,28H,3-4,6-7,13H2,1-2H3
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n/an/a 36n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29970
PNG
(arylpyrazole, 15)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1cccnc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H22Cl2N4/c1-14-19(13-25-17-6-2-3-7-17)26-27(20-9-8-16(22)11-18(20)23)21(14)15-5-4-10-24-12-15/h4-5,8-12,17,25H,2-3,6-7,13H2,1H3
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n/an/a 37n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29972
PNG
(arylpyrazole, 17)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1cccnc1)-c1ncccc1Cl
Show InChI InChI=1S/C20H22ClN5/c1-14-18(13-24-16-7-2-3-8-16)25-26(20-17(21)9-5-11-23-20)19(14)15-6-4-10-22-12-15/h4-6,9-12,16,24H,2-3,7-8,13H2,1H3
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n/an/a 61n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29975
PNG
(arylpyrazole, 20)
Show SMILES CCc1ccc(cn1)-c1c(C)c(CNC2CCCC2)nn1-c1ncccc1Cl
Show InChI InChI=1S/C22H26ClN5/c1-3-17-11-10-16(13-25-17)21-15(2)20(14-26-18-7-4-5-8-18)27-28(21)22-19(23)9-6-12-24-22/h6,9-13,18,26H,3-5,7-8,14H2,1-2H3
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n/an/a 67n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29980
PNG
(arylpyrazole, 25)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(C)nc1)-c1ncccc1S(C)(=O)=O
Show InChI InChI=1S/C22H27N5O2S/c1-15-10-11-17(13-24-15)21-16(2)19(14-25-18-7-4-5-8-18)26-27(21)22-20(30(3,28)29)9-6-12-23-22/h6,9-13,18,25H,4-5,7-8,14H2,1-3H3
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n/an/a 72n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29964
PNG
(arylpyrazole, 9)
Show SMILES Cc1c(CNC2CCCCC2)nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C23H24Cl3N3/c1-15-21(14-27-19-5-3-2-4-6-19)28-29(22-12-11-18(25)13-20(22)26)23(15)16-7-9-17(24)10-8-16/h7-13,19,27H,2-6,14H2,1H3
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n/an/a 75n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29963
PNG
(arylpyrazole, 8)
Show SMILES CC(C)CCNCc1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C22H24Cl3N3/c1-14(2)10-11-26-13-20-15(3)22(16-4-6-17(23)7-5-16)28(27-20)21-9-8-18(24)12-19(21)25/h4-9,12,14,26H,10-11,13H2,1-3H3
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n/an/a 150n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29962
PNG
(arylpyrazole, 7)
Show SMILES CC(C)CNCc1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H22Cl3N3/c1-13(2)11-25-12-19-14(3)21(15-4-6-16(22)7-5-15)27(26-19)20-9-8-17(23)10-18(20)24/h4-10,13,25H,11-12H2,1-3H3
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n/an/a 150n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29976
PNG
(arylpyrazole, 21)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(nc1)C(F)(F)F)-c1ncccc1Cl
Show InChI InChI=1S/C21H21ClF3N5/c1-13-17(12-27-15-5-2-3-6-15)29-30(20-16(22)7-4-10-26-20)19(13)14-8-9-18(28-11-14)21(23,24)25/h4,7-11,15,27H,2-3,5-6,12H2,1H3
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n/an/a 270n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29960
PNG
(arylpyrazole, 1)
Show SMILES CC(C)NCc1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C20H20Cl3N3/c1-12(2)24-11-18-13(3)20(14-4-6-15(21)7-5-14)26(25-18)19-9-8-16(22)10-17(19)23/h4-10,12,24H,11H2,1-3H3
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n/an/a 350n/a 480n/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29969
PNG
(arylpyrazole, 14)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccccn1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H22Cl2N4/c1-14-19(13-25-16-6-2-3-7-16)26-27(20-10-9-15(22)12-17(20)23)21(14)18-8-4-5-11-24-18/h4-5,8-12,16,25H,2-3,6-7,13H2,1H3
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n/an/a 530n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29967
PNG
(arylpyrazole, 12)
Show SMILES Cc1c(CN2CCCCC2)nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C22H22Cl3N3/c1-15-20(14-27-11-3-2-4-12-27)26-28(21-10-9-18(24)13-19(21)25)22(15)16-5-7-17(23)8-6-16/h5-10,13H,2-4,11-12,14H2,1H3
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n/an/a 560n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29966
PNG
(arylpyrazole, 11)
Show SMILES CC(C)N(Cc1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C1CCCCC1
Show InChI InChI=1S/C26H30Cl3N3/c1-17(2)31(22-7-5-4-6-8-22)16-24-18(3)26(19-9-11-20(27)12-10-19)32(30-24)25-14-13-21(28)15-23(25)29/h9-15,17,22H,4-8,16H2,1-3H3
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n/an/a>1.00E+3n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29971
PNG
(arylpyrazole, 16)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccncc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H22Cl2N4/c1-14-19(13-25-17-4-2-3-5-17)26-27(20-7-6-16(22)12-18(20)23)21(14)15-8-10-24-11-9-15/h6-12,17,25H,2-5,13H2,1H3
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n/an/a>1.00E+3n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))		BDBM29965
PNG
(arylpyrazole, 10)
Show SMILES CN(Cc1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C1CCCCC1
Show InChI InChI=1S/C24H26Cl3N3/c1-16-22(15-29(2)20-6-4-3-5-7-20)28-30(23-13-12-19(26)14-21(23)27)24(16)17-8-10-18(25)11-9-17/h8-14,20H,3-7,15H2,1-2H3
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n/an/a>1.00E+3n/an/an/an/a7.437



Banyu Pharmaceutical Co.



Assay Description
Compounds were tested for their inhibitory effects on ligand binding to the human ORL1 receptor. Bound and free radioligands are separated by filtra...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29981
PNG
(arylpyrazole, 26)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(C)nc1)-c1ncc(Cl)cc1Cl
Show InChI InChI=1S/C21H23Cl2N5/c1-13-7-8-15(10-24-13)20-14(2)19(12-25-17-5-3-4-6-17)27-28(20)21-18(23)9-16(22)11-26-21/h7-11,17,25H,3-6,12H2,1-2H3
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n/an/a 1.20E+3n/an/an/an/a7.422



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29973
PNG
(arylpyrazole, 18)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(Cl)nc1)-c1ncccc1Cl
Show InChI InChI=1S/C20H21Cl2N5/c1-13-17(12-24-15-5-2-3-6-15)26-27(20-16(21)7-4-10-23-20)19(13)14-8-9-18(22)25-11-14/h4,7-11,15,24H,2-3,5-6,12H2,1H3
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n/an/a 2.70E+3n/an/an/an/a7.422



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29970
PNG
(arylpyrazole, 15)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1cccnc1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H22Cl2N4/c1-14-19(13-25-17-6-2-3-7-17)26-27(20-9-8-16(22)11-18(20)23)21(14)15-5-4-10-24-12-15/h4-5,8-12,17,25H,2-3,6-7,13H2,1H3
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n/an/a 2.90E+3n/an/an/an/a7.422



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29977
PNG
(arylpyrazole, 22)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1cncc(C)c1)-c1ncccc1Cl
Show InChI InChI=1S/C21H24ClN5/c1-14-10-16(12-23-11-14)20-15(2)19(13-25-17-6-3-4-7-17)26-27(20)21-18(22)8-5-9-24-21/h5,8-12,17,25H,3-4,6-7,13H2,1-2H3
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n/an/a 9.00E+3n/an/an/an/a7.422



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29974
PNG
(arylpyrazole, 19)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1ccc(C)nc1)-c1ncccc1Cl
Show InChI InChI=1S/C21H24ClN5/c1-14-9-10-16(12-24-14)20-15(2)19(13-25-17-6-3-4-7-17)26-27(20)21-18(22)8-5-11-23-21/h5,8-12,17,25H,3-4,6-7,13H2,1-2H3
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n/an/a 1.60E+4n/an/an/an/a7.422



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29984
PNG
(arylpyrazole, 29)
Show SMILES Cc1c(CNC2CCC(F)(F)C2)nn(c1-c1ccc(C)nc1)-c1ncccc1Cl
Show InChI InChI=1S/C21H22ClF2N5/c1-13-5-6-15(11-26-13)19-14(2)18(12-27-16-7-8-21(23,24)10-16)28-29(19)20-17(22)4-3-9-25-20/h3-6,9,11,16,27H,7-8,10,12H2,1-2H3
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n/an/a 2.10E+4n/an/an/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29985
PNG
(arylpyrazole, 30)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1cnc(C)c(F)c1)-c1ncccc1Cl
Show InChI InChI=1S/C21H23ClFN5/c1-13-19(12-26-16-6-3-4-7-16)27-28(21-17(22)8-5-9-24-21)20(13)15-10-18(23)14(2)25-11-15/h5,8-11,16,26H,3-4,6-7,12H2,1-2H3
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n/an/a 2.30E+4n/an/an/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29972
PNG
(arylpyrazole, 17)
Show SMILES Cc1c(CNC2CCCC2)nn(c1-c1cccnc1)-c1ncccc1Cl
Show InChI InChI=1S/C20H22ClN5/c1-14-18(13-24-16-7-2-3-8-16)25-26(20-17(21)9-5-11-23-20)19(14)15-6-4-10-22-12-15/h4-6,9-12,16,24H,2-3,7-8,13H2,1H3
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n/an/a 2.30E+4n/an/an/an/a7.422



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29983
PNG
(arylpyrazole, 28)
Show SMILES Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(c1-c1ccc(C)nc1)-c1ncccc1Cl |r|
Show InChI InChI=1S/C21H23ClFN5/c1-13-5-6-15(11-25-13)20-14(2)19(12-26-17-8-7-16(23)10-17)27-28(20)21-18(22)4-3-9-24-21/h3-6,9,11,16-17,26H,7-8,10,12H2,1-2H3/t16-,17+/m1/s1
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n/an/a 2.90E+4n/an/an/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29982
PNG
(arylpyrazole, 27)
Show SMILES Cc1c(CNC2CCCC2F)nn(c1-c1ccc(C)nc1)-c1ncccc1Cl
Show InChI InChI=1S/C21H23ClFN5/c1-13-8-9-15(11-25-13)20-14(2)19(12-26-18-7-3-6-17(18)23)27-28(20)21-16(22)5-4-10-24-21/h4-5,8-11,17-18,26H,3,6-7,12H2,1-2H3
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n/an/a 3.00E+4n/an/an/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM29986
PNG
(arylpyrazole, 31)
Show SMILES Cc1c(CN[C@H]2CC[C@@H](F)C2)nn(c1-c1cnc(C)c(F)c1)-c1ncccc1Cl |r|
Show InChI InChI=1S/C21H22ClF2N5/c1-12-19(11-27-16-6-5-15(23)9-16)28-29(21-17(22)4-3-7-25-21)20(12)14-8-18(24)13(2)26-10-14/h3-4,7-8,10,15-16,27H,5-6,9,11H2,1-2H3/t15-,16+/m1/s1
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n/an/a 4.10E+4n/an/an/an/an/an/a



Banyu Pharmaceutical Co.



Assay Description
Binding affinity to the hERG K+ channel was measured by displacement of [35S]-radiolabeled MK499 in membranes derived from HEK 293 cells stably trans...

Bioorg Med Chem Lett 19: 3627-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.116
BindingDB Entry DOI: 10.7270/Q289145G
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%