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PubMed code 27043173

Compile data set for download or QSAR
Found 47 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))
BDBM50161472
PNG
(CHEMBL3785095)
Show SMILES Oc1ccc(Br)c2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C21H25N3O3S/c1-22-12-14-23(15-13-22)16-17-27-21-9-5-8-20-19(21)10-11-24(20)28(25,26)18-6-3-2-4-7-18/h2-11H,12-17H2,1H3
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PubMed
1.70n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161467
PNG
(CHEMBL3785560)
Show SMILES Oc1ccc(Cl)c2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C23H27ClN2O/c24-21-5-6-22(27)19-14-25-17(13-18(19)21)15-26-11-9-23(10-12-26)8-7-16-3-1-2-4-20(16)23/h1-6,17,25,27H,7-15H2
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2.20n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161471
PNG
(CHEMBL3785718)
Show SMILES Oc1cccc2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C20H22N2O4S/c23-27(24,17-5-2-1-3-6-17)22-10-9-18-19(22)7-4-8-20(18)26-16-13-21-11-14-25-15-12-21/h1-10H,11-16H2
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2.40n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161400
PNG
(CHEMBL3785952)
Show SMILES Cc1cc(F)ccc1C1CCN(CC2Cc3c(Cl)ccc(O)c3CN2)CC1
Show InChI InChI=1S/C22H26ClFN2O/c1-14-10-16(24)2-3-18(14)15-6-8-26(9-7-15)13-17-11-19-20(12-25-17)22(27)5-4-21(19)23/h2-5,10,15,17,25,27H,6-9,11-13H2,1H3
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3.10n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161399
PNG
(CHEMBL3786469)
Show SMILES Cc1cc(F)ccc1C1CCN(CC2Cc3ccccc3CN2)CC1
Show InChI InChI=1S/C22H27FN2/c1-16-12-20(23)6-7-22(16)17-8-10-25(11-9-17)15-21-13-18-4-2-3-5-19(18)14-24-21/h2-7,12,17,21,24H,8-11,13-15H2,1H3
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3.60n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161474
PNG
(CHEMBL3787174)
Show SMILES C(C1CCc2ccccc2C1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C16H16N2O3S/c17-9-11-21-14-6-7-16-13(12-14)8-10-18(16)22(19,20)15-4-2-1-3-5-15/h1-8,10,12H,9,11,17H2
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5.60n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161475
PNG
(CHEMBL3785605)
Show SMILES C(C1COc2ccccc2C1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C16H16N2O3S/c17-10-12-21-16-8-4-7-15-14(16)9-11-18(15)22(19,20)13-5-2-1-3-6-13/h1-9,11H,10,12,17H2
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5.70n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161402
PNG
(CHEMBL3786899)
Show SMILES C(C1Cc2ccccc2CN1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C23H28N2/c1-2-7-20-16-24-21(15-19(20)6-1)17-25-13-11-23(12-14-25)10-9-18-5-3-4-8-22(18)23/h1-8,21,24H,9-17H2
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8.5n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161473
PNG
(CHEMBL3785728)
Show SMILES Oc1ccc2CNC(CN3CCC4(CCc5ccccc45)CC3)Cc2c1
Show InChI InChI=1S/C22H27N3O3S/c1-23-12-6-13-24(16-15-23)17-18-28-22-10-5-9-21-20(22)11-14-25(21)29(26,27)19-7-3-2-4-8-19/h2-5,7-11,14H,6,12-13,15-18H2,1H3
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10n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161476
PNG
(CHEMBL3785839)
Show SMILES NC(=O)N1Cc2ccccc2CC1CN1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C17H18N2O3S/c1-18-11-13-22-17-9-5-8-16-15(17)10-12-19(16)23(20,21)14-6-3-2-4-7-14/h2-10,12,18H,11,13H2,1H3
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18n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161403
PNG
(CHEMBL3786338)
Show SMILES CN1Cc2ccccc2CC1CN1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C24H30N2/c1-25-17-21-8-3-2-7-20(21)16-22(25)18-26-14-12-24(13-15-26)11-10-19-6-4-5-9-23(19)24/h2-9,22H,10-18H2,1H3
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19n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161405
PNG
(CHEMBL3787051)
Show SMILES CC(=O)N1Cc2ccccc2CC1CN1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C25H30N2O/c1-19(28)27-17-22-8-3-2-7-21(22)16-23(27)18-26-14-12-25(13-15-26)11-10-20-6-4-5-9-24(20)25/h2-9,23H,10-18H2,1H3
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30n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161475
PNG
(CHEMBL3785605)
Show SMILES C(C1COc2ccccc2C1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C16H16N2O3S/c17-10-12-21-16-8-4-7-15-14(16)9-11-18(15)22(19,20)13-5-2-1-3-6-13/h1-9,11H,10,12,17H2
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49n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161403
PNG
(CHEMBL3786338)
Show SMILES CN1Cc2ccccc2CC1CN1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C24H30N2/c1-25-17-21-8-3-2-7-20(21)16-22(25)18-26-14-12-24(13-15-26)11-10-19-6-4-5-9-23(19)24/h2-9,22H,10-18H2,1H3
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58n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161467
PNG
(CHEMBL3785560)
Show SMILES Oc1ccc(Cl)c2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C23H27ClN2O/c24-21-5-6-22(27)19-14-25-17(13-18(19)21)15-26-11-9-23(10-12-26)8-7-16-3-1-2-4-20(16)23/h1-6,17,25,27H,7-15H2
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69n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161405
PNG
(CHEMBL3787051)
Show SMILES CC(=O)N1Cc2ccccc2CC1CN1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C25H30N2O/c1-19(28)27-17-22-8-3-2-7-21(22)16-23(27)18-26-14-12-25(13-15-26)11-10-20-6-4-5-9-24(20)25/h2-9,23H,10-18H2,1H3
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74n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161476
PNG
(CHEMBL3785839)
Show SMILES NC(=O)N1Cc2ccccc2CC1CN1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C17H18N2O3S/c1-18-11-13-22-17-9-5-8-16-15(17)10-12-19(16)23(20,21)14-6-3-2-4-7-14/h2-10,12,18H,11,13H2,1H3
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108n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161472
PNG
(CHEMBL3785095)
Show SMILES Oc1ccc(Br)c2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C21H25N3O3S/c1-22-12-14-23(15-13-22)16-17-27-21-9-5-8-20-19(21)10-11-24(20)28(25,26)18-6-3-2-4-7-18/h2-11H,12-17H2,1H3
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139n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161402
PNG
(CHEMBL3786899)
Show SMILES C(C1Cc2ccccc2CN1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C23H28N2/c1-2-7-20-16-24-21(15-19(20)6-1)17-25-13-11-23(12-14-25)10-9-18-5-3-4-8-22(18)23/h1-8,21,24H,9-17H2
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225n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161404
PNG
(CHEMBL3786486)
Show SMILES CN1C(CN2CCC3(CCc4ccccc34)CC2)Cc2ccccc2C1=O
Show InChI InChI=1S/C24H28N2O/c1-25-20(16-19-7-2-4-8-21(19)23(25)27)17-26-14-12-24(13-15-26)11-10-18-6-3-5-9-22(18)24/h2-9,20H,10-17H2,1H3
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231n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161404
PNG
(CHEMBL3786486)
Show SMILES CN1C(CN2CCC3(CCc4ccccc34)CC2)Cc2ccccc2C1=O
Show InChI InChI=1S/C24H28N2O/c1-25-20(16-19-7-2-4-8-21(19)23(25)27)17-26-14-12-24(13-15-26)11-10-18-6-3-5-9-22(18)24/h2-9,20H,10-17H2,1H3
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>250n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161401
PNG
(CHEMBL3786946)
Show SMILES O=C(C1Cc2ccccc2CN1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C23H26N2O/c26-22(21-15-18-6-1-2-7-19(18)16-24-21)25-13-11-23(12-14-25)10-9-17-5-3-4-8-20(17)23/h1-8,21,24H,9-16H2
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>250n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]N/OFQ from human NOP receptor expressed in HEK293 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161471
PNG
(CHEMBL3785718)
Show SMILES Oc1cccc2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C20H22N2O4S/c23-27(24,17-5-2-1-3-6-17)22-10-9-18-19(22)7-4-8-20(18)26-16-13-21-11-14-25-15-12-21/h1-10H,11-16H2
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288n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161474
PNG
(CHEMBL3787174)
Show SMILES C(C1CCc2ccccc2C1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C16H16N2O3S/c17-9-11-21-14-6-7-16-13(12-14)8-10-18(16)22(19,20)15-4-2-1-3-5-15/h1-8,10,12H,9,11,17H2
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289n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161399
PNG
(CHEMBL3786469)
Show SMILES Cc1cc(F)ccc1C1CCN(CC2Cc3ccccc3CN2)CC1
Show InChI InChI=1S/C22H27FN2/c1-16-12-20(23)6-7-22(16)17-8-10-25(11-9-17)15-21-13-18-4-2-3-5-19(18)14-24-21/h2-7,12,17,21,24H,8-11,13-15H2,1H3
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342n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161473
PNG
(CHEMBL3785728)
Show SMILES Oc1ccc2CNC(CN3CCC4(CCc5ccccc45)CC3)Cc2c1
Show InChI InChI=1S/C22H27N3O3S/c1-23-12-6-13-24(16-15-23)17-18-28-22-10-5-9-21-20(22)11-14-25(21)29(26,27)19-7-3-2-4-8-19/h2-5,7-11,14H,6,12-13,15-18H2,1H3
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392n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161401
PNG
(CHEMBL3786946)
Show SMILES O=C(C1Cc2ccccc2CN1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C23H26N2O/c26-22(21-15-18-6-1-2-7-19(18)16-24-21)25-13-11-23(12-14-25)10-9-17-5-3-4-8-20(17)23/h1-8,21,24H,9-16H2
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>450n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50161400
PNG
(CHEMBL3785952)
Show SMILES Cc1cc(F)ccc1C1CCN(CC2Cc3c(Cl)ccc(O)c3CN2)CC1
Show InChI InChI=1S/C22H26ClFN2O/c1-14-10-16(24)2-3-18(14)15-6-8-26(9-7-15)13-17-11-19-20(12-25-17)22(27)5-4-21(19)23/h2-5,10,15,17,25,27H,6-9,11-13H2,1H3
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>450n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHOK1 cells after 45 mins by scintillation proximity assay


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161467
PNG
(CHEMBL3785560)
Show SMILES Oc1ccc(Cl)c2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C23H27ClN2O/c24-21-5-6-22(27)19-14-25-17(13-18(19)21)15-26-11-9-23(10-12-26)8-7-16-3-1-2-4-20(16)23/h1-6,17,25,27H,7-15H2
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n/an/a 21n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human NOP receptor expressed in HEK293 cells assessed as inhibition of N/OFQ-induced [35S]GTPgammaS binding after 1.5 hrs by s...


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161400
PNG
(CHEMBL3785952)
Show SMILES Cc1cc(F)ccc1C1CCN(CC2Cc3c(Cl)ccc(O)c3CN2)CC1
Show InChI InChI=1S/C22H26ClFN2O/c1-14-10-16(24)2-3-18(14)15-6-8-26(9-7-15)13-17-11-19-20(12-25-17)22(27)5-4-21(19)23/h2-5,10,15,17,25,27H,6-9,11-13H2,1H3
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n/an/a 29n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human NOP receptor expressed in HEK293 cells assessed as inhibition of N/OFQ-induced [35S]GTPgammaS binding after 1.5 hrs by s...


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161472
PNG
(CHEMBL3785095)
Show SMILES Oc1ccc(Br)c2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C21H25N3O3S/c1-22-12-14-23(15-13-22)16-17-27-21-9-5-8-20-19(21)10-11-24(20)28(25,26)18-6-3-2-4-7-18/h2-11H,12-17H2,1H3
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n/an/a 35n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human NOP receptor expressed in HEK293 cells assessed as inhibition of N/OFQ-induced [35S]GTPgammaS binding after 1.5 hrs by s...


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161471
PNG
(CHEMBL3785718)
Show SMILES Oc1cccc2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C20H22N2O4S/c23-27(24,17-5-2-1-3-6-17)22-10-9-18-19(22)7-4-8-20(18)26-16-13-21-11-14-25-15-12-21/h1-10H,11-16H2
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n/an/a 54n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human NOP receptor expressed in HEK293 cells assessed as inhibition of N/OFQ-induced [35S]GTPgammaS binding after 1.5 hrs by s...


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161399
PNG
(CHEMBL3786469)
Show SMILES Cc1cc(F)ccc1C1CCN(CC2Cc3ccccc3CN2)CC1
Show InChI InChI=1S/C22H27FN2/c1-16-12-20(23)6-7-22(16)17-8-10-25(11-9-17)15-21-13-18-4-2-3-5-19(18)14-24-21/h2-7,12,17,21,24H,8-11,13-15H2,1H3
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n/an/a 59n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human NOP receptor expressed in HEK293 cells assessed as inhibition of N/OFQ-induced [35S]GTPgammaS binding after 1.5 hrs by s...


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161475
PNG
(CHEMBL3785605)
Show SMILES C(C1COc2ccccc2C1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C16H16N2O3S/c17-10-12-21-16-8-4-7-15-14(16)9-11-18(15)22(19,20)13-5-2-1-3-6-13/h1-9,11H,10,12,17H2
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n/an/a 122n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human NOP receptor expressed in HEK293 cells assessed as inhibition of N/OFQ-induced [35S]GTPgammaS binding after 1.5 hrs by s...


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161399
PNG
(CHEMBL3786469)
Show SMILES Cc1cc(F)ccc1C1CCN(CC2Cc3ccccc3CN2)CC1
Show InChI InChI=1S/C22H27FN2/c1-16-12-20(23)6-7-22(16)17-8-10-25(11-9-17)15-21-13-18-4-2-3-5-19(18)14-24-21/h2-7,12,17,21,24H,8-11,13-15H2,1H3
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n/an/a 200n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161473
PNG
(CHEMBL3785728)
Show SMILES Oc1ccc2CNC(CN3CCC4(CCc5ccccc45)CC3)Cc2c1
Show InChI InChI=1S/C22H27N3O3S/c1-23-12-6-13-24(16-15-23)17-18-28-22-10-5-9-21-20(22)11-14-25(21)29(26,27)19-7-3-2-4-8-19/h2-5,7-11,14H,6,12-13,15-18H2,1H3
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n/an/a 227n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human NOP receptor expressed in HEK293 cells assessed as inhibition of N/OFQ-induced [35S]GTPgammaS binding after 1.5 hrs by s...


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161402
PNG
(CHEMBL3786899)
Show SMILES C(C1Cc2ccccc2CN1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C23H28N2/c1-2-7-20-16-24-21(15-19(20)6-1)17-25-13-11-23(12-14-25)10-9-18-5-3-4-8-22(18)23/h1-8,21,24H,9-17H2
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n/an/a 248n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human NOP receptor expressed in HEK293 cells assessed as inhibition of N/OFQ-induced [35S]GTPgammaS binding after 1.5 hrs by s...


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161473
PNG
(CHEMBL3785728)
Show SMILES Oc1ccc2CNC(CN3CCC4(CCc5ccccc45)CC3)Cc2c1
Show InChI InChI=1S/C22H27N3O3S/c1-23-12-6-13-24(16-15-23)17-18-28-22-10-5-9-21-20(22)11-14-25(21)29(26,27)19-7-3-2-4-8-19/h2-5,7-11,14H,6,12-13,15-18H2,1H3
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n/an/a 340n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161405
PNG
(CHEMBL3787051)
Show SMILES CC(=O)N1Cc2ccccc2CC1CN1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C25H30N2O/c1-19(28)27-17-22-8-3-2-7-21(22)16-23(27)18-26-14-12-25(13-15-26)11-10-20-6-4-5-9-24(20)25/h2-9,23H,10-18H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50161474
PNG
(CHEMBL3787174)
Show SMILES C(C1CCc2ccccc2C1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C16H16N2O3S/c17-9-11-21-14-6-7-16-13(12-14)8-10-18(16)22(19,20)15-4-2-1-3-5-15/h1-8,10,12H,9,11,17H2
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n/an/a 683n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human NOP receptor expressed in HEK293 cells assessed as inhibition of N/OFQ-induced [35S]GTPgammaS binding after 1.5 hrs by s...


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161471
PNG
(CHEMBL3785718)
Show SMILES Oc1cccc2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C20H22N2O4S/c23-27(24,17-5-2-1-3-6-17)22-10-9-18-19(22)7-4-8-20(18)26-16-13-21-11-14-25-15-12-21/h1-10H,11-16H2
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n/an/a 940n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161400
PNG
(CHEMBL3785952)
Show SMILES Cc1cc(F)ccc1C1CCN(CC2Cc3c(Cl)ccc(O)c3CN2)CC1
Show InChI InChI=1S/C22H26ClFN2O/c1-14-10-16(24)2-3-18(14)15-6-8-26(9-7-15)13-17-11-19-20(12-25-17)22(27)5-4-21(19)23/h2-5,10,15,17,25,27H,6-9,11-13H2,1H3
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n/an/a 970n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161472
PNG
(CHEMBL3785095)
Show SMILES Oc1ccc(Br)c2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C21H25N3O3S/c1-22-12-14-23(15-13-22)16-17-27-21-9-5-8-20-19(21)10-11-24(20)28(25,26)18-6-3-2-4-7-18/h2-11H,12-17H2,1H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161402
PNG
(CHEMBL3786899)
Show SMILES C(C1Cc2ccccc2CN1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C23H28N2/c1-2-7-20-16-24-21(15-19(20)6-1)17-25-13-11-23(12-14-25)10-9-18-5-3-4-8-22(18)23/h1-8,21,24H,9-17H2
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n/an/a>1.50E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161475
PNG
(CHEMBL3785605)
Show SMILES C(C1COc2ccccc2C1)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C16H16N2O3S/c17-10-12-21-16-8-4-7-15-14(16)9-11-18(15)22(19,20)13-5-2-1-3-6-13/h1-9,11H,10,12,17H2
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n/an/a 1.50E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161467
PNG
(CHEMBL3785560)
Show SMILES Oc1ccc(Cl)c2CC(CN3CCC4(CCc5ccccc45)CC3)NCc12
Show InChI InChI=1S/C23H27ClN2O/c24-21-5-6-22(27)19-14-25-17(13-18(19)21)15-26-11-9-23(10-12-26)8-7-16-3-1-2-4-20(16)23/h1-6,17,25,27H,7-15H2
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n/an/a 1.73E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50161404
PNG
(CHEMBL3786486)
Show SMILES CN1C(CN2CCC3(CCc4ccccc34)CC2)Cc2ccccc2C1=O
Show InChI InChI=1S/C24H28N2O/c1-25-20(16-19-7-2-4-8-21(19)23(25)27)17-26-14-12-24(13-15-26)11-10-18-6-3-5-9-22(18)24/h2-9,20H,10-17H2,1H3
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n/an/a 6.96E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG channel expressed in HEK293 cells after 60 mins by liquid scintillation counting method


Eur J Med Chem 114: 345-64 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.014
BindingDB Entry DOI: 10.7270/Q2DV1MS3
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%