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Compile Data Set for Download or QSAR

Found 76 hits with Last Name = 'klaveness' and Initial = 'j'   
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
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023377
PNG
(CHEMBL3329805)
Show SMILES CC(C)CS(=O)(=O)Nc1ccc(CN2CCC(CNC(=O)c3c4OCCCn4c4ccccc34)CC2)cc1
Show InChI InChI=1S/C29H38N4O4S/c1-21(2)20-38(35,36)31-24-10-8-23(9-11-24)19-32-15-12-22(13-16-32)18-30-28(34)27-25-6-3-4-7-26(25)33-14-5-17-37-29(27)33/h3-4,6-11,21-22,31H,5,12-20H2,1-2H3,(H,30,34)
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0.0501n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023365
PNG
(CHEMBL3329814)
Show SMILES OCC(O)CN1CCC(COC(=O)c2c3OCCCn3c3ccccc23)CC1
Show InChI InChI=1/C21H28N2O5/c24-13-16(25)12-22-9-6-15(7-10-22)14-28-21(26)19-17-4-1-2-5-18(17)23-8-3-11-27-20(19)23/h1-2,4-5,15-16,24-25H,3,6-14H2
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0.0794n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023376
PNG
(CHEMBL3329806)
Show SMILES O=C(NCC1CCN(Cc2ccc(NS(=O)(=O)C3CCCCC3)cc2)CC1)c1c2OCCCn2c2ccccc12
Show InChI InChI=1S/C31H40N4O4S/c36-30(29-27-9-4-5-10-28(27)35-17-6-20-39-31(29)35)32-21-23-15-18-34(19-16-23)22-24-11-13-25(14-12-24)33-40(37,38)26-7-2-1-3-8-26/h4-5,9-14,23,26,33H,1-3,6-8,15-22H2,(H,32,36)
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0.200n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023375
PNG
(CHEMBL3329807)
Show SMILES CS(=O)(=O)Nc1ccc(CN2CCC(CNC(=O)c3cccc4OCCOc34)CC2)cc1
Show InChI InChI=1S/C23H29N3O5S/c1-32(28,29)25-19-7-5-18(6-8-19)16-26-11-9-17(10-12-26)15-24-23(27)20-3-2-4-21-22(20)31-14-13-30-21/h2-8,17,25H,9-16H2,1H3,(H,24,27)
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0.200n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023373
PNG
(CHEMBL3329809)
Show SMILES CC(C)CS(=O)(=O)Nc1ccc(CN2CCC(CNC(=O)c3cccc4OCCOc34)CC2)cc1
Show InChI InChI=1S/C26H35N3O5S/c1-19(2)18-35(31,32)28-22-8-6-21(7-9-22)17-29-12-10-20(11-13-29)16-27-26(30)23-4-3-5-24-25(23)34-15-14-33-24/h3-9,19-20,28H,10-18H2,1-2H3,(H,27,30)
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0.200n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023379
PNG
(CHEMBL3329803)
Show SMILES CS(=O)(=O)Nc1ccc(CN2CCC(CNC(=O)c3c4OCCCn4c4ccccc34)CC2)cc1
Show InChI InChI=1S/C26H32N4O4S/c1-35(32,33)28-21-9-7-20(8-10-21)18-29-14-11-19(12-15-29)17-27-25(31)24-22-5-2-3-6-23(22)30-13-4-16-34-26(24)30/h2-3,5-10,19,28H,4,11-18H2,1H3,(H,27,31)
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0.200n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023374
PNG
(CHEMBL3329808)
Show SMILES CCCCS(=O)(=O)Nc1ccc(CN2CCC(CNC(=O)c3cccc4OCCOc34)CC2)cc1
Show InChI InChI=1S/C26H35N3O5S/c1-2-3-17-35(31,32)28-22-9-7-21(8-10-22)19-29-13-11-20(12-14-29)18-27-26(30)23-5-4-6-24-25(23)34-16-15-33-24/h4-10,20,28H,2-3,11-19H2,1H3,(H,27,30)
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0.251n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM29525
PNG
(3H-GR113808 | CHEMBL518682 | GR 113808 | [3H] GR 1...)
Show SMILES Cn1cc(C(=O)OCC2CCN(CCNS(C)(=O)=O)CC2)c2ccccc12
Show InChI InChI=1S/C19H27N3O4S/c1-21-13-17(16-5-3-4-6-18(16)21)19(23)26-14-15-7-10-22(11-8-15)12-9-20-27(2,24)25/h3-6,13,15,20H,7-12,14H2,1-2H3
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0.251n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023366
PNG
(CHEMBL3329813)
Show SMILES CC(C(O)=O)c1ccc(CN2CCC(COC(=O)c3c4OCCCn4c4ccccc34)CC2)cc1
Show InChI InChI=1/C28H32N2O5/c1-19(27(31)32)22-9-7-20(8-10-22)17-29-14-11-21(12-15-29)18-35-28(33)25-23-5-2-3-6-24(23)30-13-4-16-34-26(25)30/h2-3,5-10,19,21H,4,11-18H2,1H3,(H,31,32)
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0.316n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM85026
PNG
(N-(1-Butylpiperidine-4-ylmethyl)-1,2-(trimethylene...)
Show SMILES CCCCN1CCC(CNC(=O)c2c3OCCCn3c3ccccc23)CC1
Show InChI InChI=1S/C22H31N3O2/c1-2-3-11-24-13-9-17(10-14-24)16-23-21(26)20-18-7-4-5-8-19(18)25-12-6-15-27-22(20)25/h4-5,7-8,17H,2-3,6,9-16H2,1H3,(H,23,26)
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0.398n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
HTR4


(GUINEA PIG)
BDBM50442803
PNG
(CHEMBL2440453)
Show SMILES CC(O)CCN1CCC(CNC(=O)c2c3OCCCn3c3ccccc23)CC1
Show InChI InChI=1/C22H31N3O3/c1-16(26)7-11-24-12-8-17(9-13-24)15-23-21(27)20-18-5-2-3-6-19(18)25-10-4-14-28-22(20)25/h2-3,5-6,16-17,26H,4,7-15H2,1H3,(H,23,27)
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0.794n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [125I]SB207710 from 5-HT4 receptor in guinea pig brain membranes


Bioorg Med Chem 21: 7134-45 (2013)


Article DOI: 10.1016/j.bmc.2013.09.004
BindingDB Entry DOI: 10.7270/Q2G44RRT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023378
PNG
(CHEMBL3329804)
Show SMILES CCCCS(=O)(=O)Nc1ccc(CN2CCC(CNC(=O)c3c4OCCCn4c4ccccc34)CC2)cc1
Show InChI InChI=1S/C29H38N4O4S/c1-2-3-19-38(35,36)31-24-11-9-23(10-12-24)21-32-16-13-22(14-17-32)20-30-28(34)27-25-7-4-5-8-26(25)33-15-6-18-37-29(27)33/h4-5,7-12,22,31H,2-3,6,13-21H2,1H3,(H,30,34)
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1n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023368
PNG
(CHEMBL3329812)
Show SMILES OC(=O)C1CCCC(CN2CCC(COC(=O)c3c4OCCCn4c4ccccc34)CC2)C1
Show InChI InChI=1/C26H34N2O5/c29-25(30)20-6-3-5-19(15-20)16-27-12-9-18(10-13-27)17-33-26(31)23-21-7-1-2-8-22(21)28-11-4-14-32-24(23)28/h1-2,7-8,18-20H,3-6,9-17H2,(H,29,30)
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1.30n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023367
PNG
(CHEMBL3329811)
Show SMILES OC(=O)C1CCC(CN2CCC(COC(=O)c3c4OCCCn4c4ccccc34)CC2)C1
Show InChI InChI=1/C25H32N2O5/c28-24(29)19-7-6-18(14-19)15-26-11-8-17(9-12-26)16-32-25(30)22-20-4-1-2-5-21(20)27-10-3-13-31-23(22)27/h1-2,4-5,17-19H,3,6-16H2,(H,28,29)
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1.30n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023372
PNG
(CHEMBL3329810)
Show SMILES O=C(NCC1CCN(Cc2ccc(NS(=O)(=O)C3CCCCC3)cc2)CC1)c1cccc2OCCOc12
Show InChI InChI=1S/C28H37N3O5S/c32-28(25-7-4-8-26-27(25)36-18-17-35-26)29-19-21-13-15-31(16-14-21)20-22-9-11-23(12-10-22)30-37(33,34)24-5-2-1-3-6-24/h4,7-12,21,24,30H,1-3,5-6,13-20H2,(H,29,32)
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1.30n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50009298
PNG
(CHEMBL3233521)
Show SMILES COc1nc(OCCF)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(CCC3(C)C)cc2C)o1
Show InChI InChI=1S/C25H28FN3O6/c1-14-12-15-8-9-25(2,3)16(15)13-18(14)35-19-7-6-17(34-19)21(30)27-20-22(31-4)28-24(33-11-10-26)29-23(20)32-5/h6-7,12-13H,8-11H2,1-5H3,(H,27,30)
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1.40n/an/an/an/an/an/an/an/a



Norwegian Medical Cyclotron Centre, PO Box 4950, Nydalen, N-0424 Oslo, Norway.

Curated by ChEMBL


Assay Description
Displacement of [125I]Triptorelin from rat full-length gonadotropin-releasing hormone receptor expressed in HEK293 cells


Bioorg Med Chem Lett 24: 1846-50 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.002
BindingDB Entry DOI: 10.7270/Q2XS5WXP
More data for this
Ligand-Target Pair
HTR4


(GUINEA PIG)
BDBM85026
PNG
(N-(1-Butylpiperidine-4-ylmethyl)-1,2-(trimethylene...)
Show SMILES CCCCN1CCC(CNC(=O)c2c3OCCCn3c3ccccc23)CC1
Show InChI InChI=1S/C22H31N3O2/c1-2-3-11-24-13-9-17(10-14-24)16-23-21(26)20-18-7-4-5-8-19(18)25-12-6-15-27-22(20)25/h4-5,7-8,17H,2-3,6,9-16H2,1H3,(H,23,26)
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1.60n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [125I]SB207710 from 5-HT4 receptor in guinea pig brain membranes


Bioorg Med Chem 21: 7134-45 (2013)


Article DOI: 10.1016/j.bmc.2013.09.004
BindingDB Entry DOI: 10.7270/Q2G44RRT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023369
PNG
(CHEMBL3329226)
Show SMILES OC(=O)C1C2C3CC1C(CN1CCC(COC(=O)c4c5OCCCn5c5ccccc45)CC1)C23
Show InChI InChI=1/C27H32N2O5/c30-26(31)23-17-12-18-21(22(18)23)19(17)13-28-9-6-15(7-10-28)14-34-27(32)24-16-4-1-2-5-20(16)29-8-3-11-33-25(24)29/h1-2,4-5,15,17-19,21-23H,3,6-14H2,(H,30,31)
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1.60n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Mus musculus)
BDBM50261184
PNG
(5-((3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphth...)
Show SMILES COc1cc(OC)c(NC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)c(OC)c1
Show InChI InChI=1S/C30H37NO5/c1-18-13-22-23(30(4,5)12-11-29(22,2)3)15-19(18)14-20-9-10-24(36-20)28(32)31-27-25(34-7)16-21(33-6)17-26(27)35-8/h9-10,13,15-17H,11-12,14H2,1-8H3,(H,31,32)
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2.20n/an/an/an/an/an/an/an/a



Norwegian Medical Cyclotron Centre, PO Box 4950, Nydalen, N-0424 Oslo, Norway.

Curated by ChEMBL


Assay Description
Binding affinity to mouse gonadotropin-releasing hormone receptor by radioligand displacement assay


Bioorg Med Chem Lett 24: 1846-50 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.002
BindingDB Entry DOI: 10.7270/Q2XS5WXP
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50261184
PNG
(5-((3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphth...)
Show SMILES COc1cc(OC)c(NC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)c(OC)c1
Show InChI InChI=1S/C30H37NO5/c1-18-13-22-23(30(4,5)12-11-29(22,2)3)15-19(18)14-20-9-10-24(36-20)28(32)31-27-25(34-7)16-21(33-6)17-26(27)35-8/h9-10,13,15-17H,11-12,14H2,1-8H3,(H,31,32)
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3.80n/an/an/an/an/an/an/an/a



Norwegian Medical Cyclotron Centre, PO Box 4950, Nydalen, N-0424 Oslo, Norway.

Curated by ChEMBL


Assay Description
Binding affinity to rat gonadotropin-releasing hormone receptor by radioligand displacement assay


Bioorg Med Chem Lett 24: 1846-50 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.002
BindingDB Entry DOI: 10.7270/Q2XS5WXP
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50261184
PNG
(5-((3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphth...)
Show SMILES COc1cc(OC)c(NC(=O)c2ccc(Cc3cc4c(cc3C)C(C)(C)CCC4(C)C)o2)c(OC)c1
Show InChI InChI=1S/C30H37NO5/c1-18-13-22-23(30(4,5)12-11-29(22,2)3)15-19(18)14-20-9-10-24(36-20)28(32)31-27-25(34-7)16-21(33-6)17-26(27)35-8/h9-10,13,15-17H,11-12,14H2,1-8H3,(H,31,32)
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6n/an/an/an/an/an/an/an/a



Norwegian Medical Cyclotron Centre, PO Box 4950, Nydalen, N-0424 Oslo, Norway.

Curated by ChEMBL


Assay Description
Binding affinity to human gonadotropin-releasing hormone receptor by radioligand displacement assay


Bioorg Med Chem Lett 24: 1846-50 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.002
BindingDB Entry DOI: 10.7270/Q2XS5WXP
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50224310
PNG
(5-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydro-naphth...)
Show SMILES Cc1cc2c(cc1Cc1ccc(o1)C(=O)NCC1CCC(CN=C(N)N)CC1)C(C)(C)CCC2(C)C
Show InChI InChI=1S/C30H44N4O2/c1-19-14-24-25(30(4,5)13-12-29(24,2)3)16-22(19)15-23-10-11-26(36-23)27(35)33-17-20-6-8-21(9-7-20)18-34-28(31)32/h10-11,14,16,20-21H,6-9,12-13,15,17-18H2,1-5H3,(H,33,35)(H4,31,32,34)
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40n/an/an/an/an/an/an/an/a



Norwegian Medical Cyclotron Centre, PO Box 4950, Nydalen, N-0424 Oslo, Norway.

Curated by ChEMBL


Assay Description
Binding affinity to human gonadotropin-releasing hormone receptor by radioligand displacement assay


Bioorg Med Chem Lett 24: 1846-50 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.002
BindingDB Entry DOI: 10.7270/Q2XS5WXP
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50009297
PNG
(CHEMBL3233520)
Show SMILES COc1nc(F)nc(OC)c1NC(=O)c1ccc(Oc2cc3c(CCC3(C)C)cc2C)o1
Show InChI InChI=1S/C23H24FN3O5/c1-12-10-13-8-9-23(2,3)14(13)11-16(12)32-17-7-6-15(31-17)19(28)25-18-20(29-4)26-22(24)27-21(18)30-5/h6-7,10-11H,8-9H2,1-5H3,(H,25,28)
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42n/an/an/an/an/an/an/an/a



Norwegian Medical Cyclotron Centre, PO Box 4950, Nydalen, N-0424 Oslo, Norway.

Curated by ChEMBL


Assay Description
Displacement of [125I]Triptorelin from rat full-length gonadotropin-releasing hormone receptor expressed in HEK293 cells


Bioorg Med Chem Lett 24: 1846-50 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.002
BindingDB Entry DOI: 10.7270/Q2XS5WXP
More data for this
Ligand-Target Pair
HTR4


(GUINEA PIG)
BDBM50442804
PNG
(CHEMBL2440452)
Show SMILES O=C(NCC1CCNCC1)c1c2OCCCn2c2ccccc12
Show InChI InChI=1S/C18H23N3O2/c22-17(20-12-13-6-8-19-9-7-13)16-14-4-1-2-5-15(14)21-10-3-11-23-18(16)21/h1-2,4-5,13,19H,3,6-12H2,(H,20,22)
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63n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [125I]SB207710 from 5-HT4 receptor in guinea pig brain membranes


Bioorg Med Chem 21: 7134-45 (2013)


Article DOI: 10.1016/j.bmc.2013.09.004
BindingDB Entry DOI: 10.7270/Q2G44RRT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023381
PNG
(CHEMBL3329801)
Show SMILES O=C(NCC1CCN(Cc2ccc(NS(=O)(=O)C3CCCCC3)cc2)CC1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C28H36N4O3S/c33-28(26-19-29-27-9-5-4-8-25(26)27)30-18-21-14-16-32(17-15-21)20-22-10-12-23(13-11-22)31-36(34,35)24-6-2-1-3-7-24/h4-5,8-13,19,21,24,29,31H,1-3,6-7,14-18,20H2,(H,30,33)
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501n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
HTR4


(GUINEA PIG)
BDBM50442805
PNG
(CHEMBL2440451)
Show SMILES CCCCN1CCC(CNC(=O)c2c3OCCCn3c3cc(O)ccc23)CC1
Show InChI InChI=1S/C22H31N3O3/c1-2-3-9-24-11-7-16(8-12-24)15-23-21(27)20-18-6-5-17(26)14-19(18)25-10-4-13-28-22(20)25/h5-6,14,16,26H,2-4,7-13,15H2,1H3,(H,23,27)
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794n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [125I]SB207710 from 5-HT4 receptor in guinea pig brain membranes


Bioorg Med Chem 21: 7134-45 (2013)


Article DOI: 10.1016/j.bmc.2013.09.004
BindingDB Entry DOI: 10.7270/Q2G44RRT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50023380
PNG
(CHEMBL3329802)
Show SMILES O=C(NCC1CCN(Cc2ccc(NS(=O)(=O)Cc3ccccc3)cc2)CC1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C29H32N4O3S/c34-29(27-19-30-28-9-5-4-8-26(27)28)31-18-22-14-16-33(17-15-22)20-23-10-12-25(13-11-23)32-37(35,36)21-24-6-2-1-3-7-24/h1-13,19,22,30,32H,14-18,20-21H2,(H,31,34)
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1.00E+3n/an/an/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human 5HT4b receptor expressed in HEK293 cell membranes


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50023366
PNG
(CHEMBL3329813)
Show SMILES CC(C(O)=O)c1ccc(CN2CCC(COC(=O)c3c4OCCCn4c4ccccc34)CC2)cc1
Show InChI InChI=1/C28H32N2O5/c1-19(27(31)32)22-9-7-20(8-10-22)17-29-14-11-21(12-15-29)18-35-28(33)25-23-5-2-3-6-24(23)30-13-4-16-34-26(25)30/h2-3,5-10,19,21H,4,11-18H2,1H3,(H,31,32)
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n/an/a 2.50E+4n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in HEK293 cells assessed as reduction in channel tail current by patch clamp method


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50023365
PNG
(CHEMBL3329814)
Show SMILES OCC(O)CN1CCC(COC(=O)c2c3OCCCn3c3ccccc23)CC1
Show InChI InChI=1/C21H28N2O5/c24-13-16(25)12-22-9-6-15(7-10-22)14-28-21(26)19-17-4-1-2-5-18(17)23-8-3-11-27-20(19)23/h1-2,4-5,15-16,24-25H,3,6-14H2
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n/an/a 8.10E+4n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in HEK293 cells assessed as reduction in channel tail current by patch clamp method


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50023367
PNG
(CHEMBL3329811)
Show SMILES OC(=O)C1CCC(CN2CCC(COC(=O)c3c4OCCCn4c4ccccc34)CC2)C1
Show InChI InChI=1/C25H32N2O5/c28-24(29)19-7-6-18(14-19)15-26-11-8-17(9-12-26)16-32-25(30)22-20-4-1-2-5-21(20)27-10-3-13-31-23(22)27/h1-2,4-5,17-19H,3,6-16H2,(H,28,29)
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n/an/a 2.09E+5n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in HEK293 cells assessed as reduction in channel tail current by patch clamp method


Bioorg Med Chem Lett 24: 4598-602 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.083
BindingDB Entry DOI: 10.7270/Q28W3FW7
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212592
PNG
(US9556111, Table 1.1 | US9951033, Compound Table 1...)
Show SMILES CC(C)(C)c1ccc(CN(Cc2nc(cs2)C(O)=O)Cc2ccc(F)cc2)cc1
Show InChI InChI=1S/C23H25FN2O2S/c1-23(2,3)18-8-4-16(5-9-18)12-26(13-17-6-10-19(24)11-7-17)14-21-25-20(15-29-21)22(27)28/h4-11,15H,12-14H2,1-3H3,(H,27,28)
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n/an/an/an/a 4.16E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212594
PNG
(US9556111, Table 1.2 | US9951033, Compound Table 1...)
Show SMILES OC(=O)c1csc(CN(Cc2ccc(F)cc2)Cc2cccc(Cl)c2)n1
Show InChI InChI=1S/C19H16ClFN2O2S/c20-15-3-1-2-14(8-15)10-23(9-13-4-6-16(21)7-5-13)11-18-22-17(12-26-18)19(24)25/h1-8,12H,9-11H2,(H,24,25)
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n/an/an/an/a 3.64E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212595
PNG
(US9556111, Table 1.3 | US9951033, Compound Table 1...)
Show SMILES Cc1ccc(CN(Cc2nc(cs2)C(O)=O)Cc2ccc(F)cc2)cc1
Show InChI InChI=1S/C20H19FN2O2S/c1-14-2-4-15(5-3-14)10-23(11-16-6-8-17(21)9-7-16)12-19-22-18(13-26-19)20(24)25/h2-9,13H,10-12H2,1H3,(H,24,25)
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n/an/an/an/a 1.37E+5n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212597
PNG
(US9556111, Table 1.4 | US9951033, Compound Table 1...)
Show SMILES OC(=O)c1csc(CN(Cc2ccc(F)cc2)Cc2ccc(OCc3ccccc3)cc2)n1
Show InChI InChI=1S/C26H23FN2O3S/c27-22-10-6-19(7-11-22)14-29(16-25-28-24(18-33-25)26(30)31)15-20-8-12-23(13-9-20)32-17-21-4-2-1-3-5-21/h1-13,18H,14-17H2,(H,30,31)
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n/an/an/an/a 3.95E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212599
PNG
(US9556111, Table 1.5 | US9951033, Compound Table 1...)
Show SMILES OC(=O)c1csc(CN(CCC(c2ccccc2)c2ccccc2)Cc2ccccc2F)n1
Show InChI InChI=1S/C27H25FN2O2S/c28-24-14-8-7-13-22(24)17-30(18-26-29-25(19-33-26)27(31)32)16-15-23(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,19,23H,15-18H2,(H,31,32)
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n/an/an/an/a 1.06E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212601
PNG
(US9556111, Table 1.6 | US9951033, Compound Table 1...)
Show SMILES OC(=O)c1csc(CN(Cc2ccc(F)cc2)Cc2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C20H16F4N2O2S/c21-16-6-4-13(5-7-16)9-26(11-18-25-17(12-29-18)19(27)28)10-14-2-1-3-15(8-14)20(22,23)24/h1-8,12H,9-11H2,(H,27,28)
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n/an/an/an/a 6.05E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212603
PNG
(US9556111, Table 1.7 | US9951033, Compound Table 1...)
Show SMILES OC(=O)c1csc(CN(CCC(c2ccccc2)c2ccccc2)Cc2ccc(F)cc2)n1
Show InChI InChI=1S/C27H25FN2O2S/c28-23-13-11-20(12-14-23)17-30(18-26-29-25(19-33-26)27(31)32)16-15-24(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,19,24H,15-18H2,(H,31,32)
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n/an/an/an/a 1.80E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212707
PNG
(US9556111, Table 1.8 | US9951033, Compound Table 1...)
Show SMILES OC(=O)c1csc(CN(Cc2ccc(F)cc2)Cc2ccc(Cl)cc2)n1
Show InChI InChI=1S/C19H16ClFN2O2S/c20-15-5-1-13(2-6-15)9-23(10-14-3-7-16(21)8-4-14)11-18-22-17(12-26-18)19(24)25/h1-8,12H,9-11H2,(H,24,25)
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n/an/an/an/a 9.43E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212709
PNG
(US9556111, Table 1.9 | US9951033, Compound Table 1...)
Show SMILES CC(C)(C)c1ccc(CN(CCC(c2ccccc2)c2ccccc2)Cc2nc(cs2)C(O)=O)cc1
Show InChI InChI=1S/C31H34N2O2S/c1-31(2,3)26-16-14-23(15-17-26)20-33(21-29-32-28(22-36-29)30(34)35)19-18-27(24-10-6-4-7-11-24)25-12-8-5-9-13-25/h4-17,22,27H,18-21H2,1-3H3,(H,34,35)
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n/an/an/an/a 2.11E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212711
PNG
(US9556111, Table 1.10 | US9951033, Compound Table ...)
Show SMILES Cc1ccc(CN(Cc2nc(cs2)C(O)=O)Cc2cccc(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H19F3N2O2S/c1-14-5-7-15(8-6-14)10-26(12-19-25-18(13-29-19)20(27)28)11-16-3-2-4-17(9-16)21(22,23)24/h2-9,13H,10-12H2,1H3,(H,27,28)
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n/an/an/an/a 9.83E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212712
PNG
(US9556111, Table 1.11 | US9951033, Compound Table ...)
Show SMILES COc1ccc(CN(Cc2nc(cs2)C(O)=O)Cc2ccc(F)cc2)cc1
Show InChI InChI=1S/C20H19FN2O3S/c1-26-17-8-4-15(5-9-17)11-23(10-14-2-6-16(21)7-3-14)12-19-22-18(13-27-19)20(24)25/h2-9,13H,10-12H2,1H3,(H,24,25)
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n/an/an/an/a 2.56E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212714
PNG
(US9556111, Table 1.12 | US9951033, Compound Table ...)
Show SMILES OC(=O)c1csc(CN(Cc2cccc(c2)C(F)(F)F)Cc2ccccc2F)n1
Show InChI InChI=1S/C20H16F4N2O2S/c21-16-7-2-1-5-14(16)10-26(11-18-25-17(12-29-18)19(27)28)9-13-4-3-6-15(8-13)20(22,23)24/h1-8,12H,9-11H2,(H,27,28)
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n/an/an/an/a 2.16E+5n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212716
PNG
(US9556111, Table 1.13 | US9951033, Compound Table ...)
Show SMILES Cc1ccc(CN(CCC(c2ccccc2)c2ccccc2)Cc2nc(cs2)C(O)=O)cc1
Show InChI InChI=1S/C28H28N2O2S/c1-21-12-14-22(15-13-21)18-30(19-27-29-26(20-33-27)28(31)32)17-16-25(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-15,20,25H,16-19H2,1H3,(H,31,32)
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n/an/an/an/a 3.54E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212718
PNG
(US9556111, Table 1.14 | US9951033, Compound Table ...)
Show SMILES [O-][N+](=O)c1ccc(CN(Cc2ccccc2)Cc2ccc(cc2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C21H19N3O4/c25-23(26)20-10-6-18(7-11-20)15-22(14-17-4-2-1-3-5-17)16-19-8-12-21(13-9-19)24(27)28/h1-13H,14-16H2
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n/an/an/an/a 7.50E+3n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212722
PNG
(US9556111, Table 1.15 | US9951033, Compound Table ...)
Show SMILES OC(=O)c1ccc(CN(Cc2ccccc2)Cc2ccc(cc2)C(O)=O)cc1
Show InChI InChI=1S/C23H21NO4/c25-22(26)20-10-6-18(7-11-20)15-24(14-17-4-2-1-3-5-17)16-19-8-12-21(13-9-19)23(27)28/h1-13H,14-16H2,(H,25,26)(H,27,28)
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n/an/an/an/a 2.96E+4n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212725
PNG
(US9556111, Table 1.16 | US9951033, Compound Table ...)
Show SMILES Fc1ccc(NC(=O)Nc2ccc(CN(Cc3ccccc3)Cc3ccc(NC(=O)Nc4ccc(F)cc4)cc3)cc2)cc1
Show InChI InChI=1S/C35H31F2N5O2/c36-28-10-18-32(19-11-28)40-34(43)38-30-14-6-26(7-15-30)23-42(22-25-4-2-1-3-5-25)24-27-8-16-31(17-9-27)39-35(44)41-33-20-12-29(37)13-21-33/h1-21H,22-24H2,(H2,38,40,43)(H2,39,41,44)
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n/an/an/an/a 9.30E+3n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212727
PNG
(US9556111, Table 1.17 | US9951033, Compound Table ...)
Show SMILES Nc1ccc(CN(Cc2ccccc2)Cc2ccc(N)cc2)cc1
Show InChI InChI=1S/C21H23N3/c22-20-10-6-18(7-11-20)15-24(14-17-4-2-1-3-5-17)16-19-8-12-21(23)13-9-19/h1-13H,14-16,22-23H2
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n/an/an/an/a 3.80E+3n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212731
PNG
(US9556111, Table 1.18 | US9951033, Compound Table ...)
Show SMILES O=C(Nc1ccccc1)Nc1ccc(CN(Cc2ccccc2)Cc2ccc(NC(=O)Nc3ccccc3)cc2)cc1
Show InChI InChI=1S/C35H33N5O2/c41-34(36-30-12-6-2-7-13-30)38-32-20-16-28(17-21-32)25-40(24-27-10-4-1-5-11-27)26-29-18-22-33(23-19-29)39-35(42)37-31-14-8-3-9-15-31/h1-23H,24-26H2,(H2,36,38,41)(H2,37,39,42)
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n/an/an/an/a 3.60E+3n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212733
PNG
(US9556111, Table 1.19 | US9951033, Compound Table ...)
Show SMILES CCN(CC)c1ccc(CN(Cc2ccccc2)Cc2ccc(cc2)N(CC)CC)cc1
Show InChI InChI=1S/C29H39N3/c1-5-31(6-2)28-18-14-26(15-19-28)23-30(22-25-12-10-9-11-13-25)24-27-16-20-29(21-17-27)32(7-3)8-4/h9-21H,5-8,22-24H2,1-4H3
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n/an/an/an/a 2.90E+3n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
A-kinase anchor protein 7 isoform gamma


(Homo sapiens (Human))
BDBM212735
PNG
(US9556111, Table 1.20)
Show SMILES Cc1ccc(NC(=O)Nc2ccc(CN(Cc3ccc(NC(=O)Nc4ccc(C)cc4)cc3)Cc3ccc(NC(=O)Nc4ccc(C)cc4)cc3)cc2)cc1
Show InChI InChI=1S/C45H45N7O3/c1-31-4-16-37(17-5-31)46-43(53)49-40-22-10-34(11-23-40)28-52(29-35-12-24-41(25-13-35)50-44(54)47-38-18-6-32(2)7-19-38)30-36-14-26-42(27-15-36)51-45(55)48-39-20-8-33(3)9-21-39/h4-27H,28-30H2,1-3H3,(H2,46,49,53)(H2,47,50,54)(H2,48,51,55)
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n/an/an/an/a 5.20E+3n/an/an/an/a



UNIVERSITETET I OSLO

US Patent


Assay Description
Stable and optimal assay conditions were determined by cross-titrating GST-AKAP18δ and biotinylated PLB using 10 μg/ml glutathione acceptor...


US Patent US9556111 (2017)


BindingDB Entry DOI: 10.7270/Q20Z758K
More data for this
Ligand-Target Pair
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