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Compile Data Set for Download or QSAR

Found 19 hits of ec50 for UniProtKB: Q16620   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50565738
PNG
(CHEMBL4794404)
Show SMILES CN1CCN(CC(=O)Nc2nc(C)c(s2)-c2ccc3c(\C=C\c4ccccn4)n[nH]c3c2)CC1
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n/an/an/an/a 69n/an/an/an/a


TBA

Assay Description
Inhibition of TEL fused wild type TRKB (unknown origin) transfected in mouse BaF3 cells assessed as reduction in phosphorylation at Y515 residue afte...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112744
BindingDB Entry DOI: 10.7270/Q20V8HJN
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50508282
PNG
(CHEMBL4471556)
Show SMILES COc1ccc(cc1)-c1cc2cccc(O)c2c(=O)o1
Show InChI InChI=1S/C16H12O4/c1-19-12-7-5-10(6-8-12)14-9-11-3-2-4-13(17)15(11)16(18)20-14/h2-9,17H,1H3
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n/an/an/an/a 87n/an/an/an/a



Indian Institute of Technology Madras

Curated by ChEMBL


Assay Description
Agonist activity at EGFP-fused TrkB receptor (unknown origin) expressed in HEK293T cells after 6 hrs by luciferase reporter gene assay


Bioorg Med Chem Lett 29: 585-590 (2019)


Article DOI: 10.1016/j.bmcl.2018.12.057
BindingDB Entry DOI: 10.7270/Q2542RVM
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50073587
PNG
(CHEMBL3408947 | US10358436, Example A185 | US20230...)
Show SMILES COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6C[C@H](C)O[C@H](C)C6)cc5)n[nH]c4c3)c2c1 |r|
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n/an/an/an/a 88n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of TRKB (unknown origin) by cell-based assay


J Med Chem 58: 147-69 (2015)


Article DOI: 10.1021/jm5005336
BindingDB Entry DOI: 10.7270/Q2M0475V
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50073587
PNG
(CHEMBL3408947 | US10358436, Example A185 | US20230...)
Show SMILES COc1ccc2NC(=O)[C@@]3(C[C@H]3c3ccc4c(\C=C\c5ccc(CN6C[C@H](C)O[C@H](C)C6)cc5)n[nH]c4c3)c2c1 |r|
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n/an/an/an/a 88n/an/an/an/a



Zhengzhou University

Curated by ChEMBL


Assay Description
Inhibition of TRKB (unknown origin)


Eur J Med Chem 95: 35-40 (2015)


Article DOI: 10.1016/j.ejmech.2015.03.020
BindingDB Entry DOI: 10.7270/Q2NG4SBV
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505011
PNG
(CHEMBL4529332)
Show SMILES COCCOc1cc(ccc1Oc1ccccc1)-n1c(=O)[nH]c(=O)n(-c2ccc(C)cc2)c1=O
Show InChI InChI=1S/C25H23N3O6/c1-17-8-10-18(11-9-17)27-23(29)26-24(30)28(25(27)31)19-12-13-21(22(16-19)33-15-14-32-2)34-20-6-4-3-5-7-20/h3-13,16H,14-15H2,1-2H3,(H,26,29,30)
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n/an/an/an/a 110n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505017
PNG
(CHEMBL4462161)
Show SMILES COCCOc1cc(ccc1Oc1ccccc1)-n1c(=O)[nH]c(=O)n(-c2cccc(C)c2)c1=O
Show InChI InChI=1S/C25H23N3O6/c1-17-7-6-8-18(15-17)27-23(29)26-24(30)28(25(27)31)19-11-12-21(22(16-19)33-14-13-32-2)34-20-9-4-3-5-10-20/h3-12,15-16H,13-14H2,1-2H3,(H,26,29,30)
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Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505010
PNG
(CHEMBL4455143)
Show SMILES COCCOc1cc(ccc1Oc1ccccc1)-n1c(=O)[nH]c(=O)n(-c2cccc(Cl)c2)c1=O
Show InChI InChI=1S/C24H20ClN3O6/c1-32-12-13-33-21-15-18(10-11-20(21)34-19-8-3-2-4-9-19)28-23(30)26-22(29)27(24(28)31)17-7-5-6-16(25)14-17/h2-11,14-15H,12-13H2,1H3,(H,26,29,30)
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Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505015
PNG
(CHEMBL4538772)
Show SMILES Brc1cc(ccc1Oc1ccccc1)-n1c(=O)[nH]c(=O)n(-c2ccccc2)c1=O
Show InChI InChI=1S/C21H14BrN3O4/c22-17-13-15(11-12-18(17)29-16-9-5-2-6-10-16)25-20(27)23-19(26)24(21(25)28)14-7-3-1-4-8-14/h1-13H,(H,23,26,27)
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Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505006
PNG
(CHEMBL4483402)
Show SMILES COc1cc(Oc2ccccc2)ccc1-n1c(=O)[nH]c(=O)n(-c2ccccc2)c1=O |(72.02,-7.51,;73.36,-8.28,;73.36,-9.82,;72.02,-10.6,;72.03,-12.14,;70.69,-12.91,;69.36,-12.15,;69.36,-10.61,;68.02,-9.84,;66.69,-10.61,;66.7,-12.16,;68.03,-12.92,;73.37,-12.91,;74.7,-12.13,;74.69,-10.6,;76.02,-9.82,;77.36,-10.59,;77.36,-12.13,;78.69,-9.82,;78.69,-8.28,;80.02,-7.52,;77.36,-7.5,;77.36,-5.96,;78.69,-5.19,;78.69,-3.65,;77.36,-2.88,;76.02,-3.66,;76.03,-5.2,;76.02,-8.28,;74.69,-7.52,)|
Show InChI InChI=1S/C22H17N3O5/c1-29-19-14-17(30-16-10-6-3-7-11-16)12-13-18(19)25-21(27)23-20(26)24(22(25)28)15-8-4-2-5-9-15/h2-14H,1H3,(H,23,26,27)
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n/an/an/an/a 270n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505012
PNG
(CHEMBL4472787)
Show SMILES CC(C)Oc1cc(ccc1Oc1ccccc1)-n1c(=O)[nH]c(=O)n(-c2ccccc2)c1=O
Show InChI InChI=1S/C24H21N3O5/c1-16(2)31-21-15-18(13-14-20(21)32-19-11-7-4-8-12-19)27-23(29)25-22(28)26(24(27)30)17-9-5-3-6-10-17/h3-16H,1-2H3,(H,25,28,29)
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n/an/an/an/a 370n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505016
PNG
(CHEMBL4527488)
Show SMILES CCOc1cc(ccc1Oc1ccccc1)-n1c(=O)[nH]c(=O)n(-c2ccccc2)c1=O
Show InChI InChI=1S/C23H19N3O5/c1-2-30-20-15-17(13-14-19(20)31-18-11-7-4-8-12-18)26-22(28)24-21(27)25(23(26)29)16-9-5-3-6-10-16/h3-15H,2H2,1H3,(H,24,27,28)
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n/an/an/an/a 370n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505007
PNG
(CHEMBL4464037)
Show SMILES Cc1cc(ccc1Oc1ccccc1)-n1c(=O)[nH]c(=O)n(-c2ccccc2)c1=O
Show InChI InChI=1S/C22H17N3O4/c1-15-14-17(12-13-19(15)29-18-10-6-3-7-11-18)25-21(27)23-20(26)24(22(25)28)16-8-4-2-5-9-16/h2-14H,1H3,(H,23,26,27)
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n/an/an/an/a 390n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505018
PNG
(CHEMBL4464173)
Show SMILES COc1cc(ccc1Oc1ccccc1)-n1c(=O)[nH]c(=O)n(-c2ccccc2)c1=O
Show InChI InChI=1S/C22H17N3O5/c1-29-19-14-16(12-13-18(19)30-17-10-6-3-7-11-17)25-21(27)23-20(26)24(22(25)28)15-8-4-2-5-9-15/h2-14H,1H3,(H,23,26,27)
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n/an/an/an/a 450n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505005
PNG
(CHEMBL4455810)
Show SMILES COCCOc1cc(ccc1Oc1ccccc1)-n1c(=O)[nH]c(=O)n(-c2ccc(Cl)cc2)c1=O
Show InChI InChI=1S/C24H20ClN3O6/c1-32-13-14-33-21-15-18(11-12-20(21)34-19-5-3-2-4-6-19)28-23(30)26-22(29)27(24(28)31)17-9-7-16(25)8-10-17/h2-12,15H,13-14H2,1H3,(H,26,29,30)
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n/an/an/an/a 460n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505013
PNG
(CHEMBL4574315)
Show SMILES Cn1c(=O)[nH]c(=O)n(-c2ccc(Oc3ccccc3)c(OCC3COC3)c2)c1=O
Show InChI InChI=1S/C20H19N3O6/c1-22-18(24)21-19(25)23(20(22)26)14-7-8-16(29-15-5-3-2-4-6-15)17(9-14)28-12-13-10-27-11-13/h2-9,13H,10-12H2,1H3,(H,21,24,25)
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Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505014
PNG
(CHEMBL4467829)
Show SMILES O=c1[nH]c(=O)n(-c2ccc(Oc3ccccc3)c(OC3CCOC3)c2)c(=O)n1-c1ccccc1
Show InChI InChI=1S/C25H21N3O6/c29-23-26-24(30)28(25(31)27(23)17-7-3-1-4-8-17)18-11-12-21(33-19-9-5-2-6-10-19)22(15-18)34-20-13-14-32-16-20/h1-12,15,20H,13-14,16H2,(H,26,29,30)
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Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505019
PNG
(CHEMBL4465865)
Show SMILES O=c1[nH]c(=O)n(-c2ccc(Oc3ccccc3)c(OCC3COC3)c2)c(=O)n1-c1ccccc1
Show InChI InChI=1S/C25H21N3O6/c29-23-26-24(30)28(25(31)27(23)18-7-3-1-4-8-18)19-11-12-21(34-20-9-5-2-6-10-20)22(13-19)33-16-17-14-32-15-17/h1-13,17H,14-16H2,(H,26,29,30)
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n/an/an/an/a 790n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505008
PNG
(CHEMBL4518577)
Show SMILES COc1cccc(c1)-n1c(=O)[nH]c(=O)n(-c2ccc(Oc3ccccc3)cc2)c1=O
Show InChI InChI=1S/C22H17N3O5/c1-29-19-9-5-6-16(14-19)25-21(27)23-20(26)24(22(25)28)15-10-12-18(13-11-15)30-17-7-3-2-4-8-17/h2-14H,1H3,(H,23,26,27)
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n/an/an/an/a 950n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair
BDNF/NT-3 growth factors receptor


(Homo sapiens (Human))
BDBM50505009
PNG
(CHEMBL4542212)
Show SMILES O=c1[nH]c(=O)n(-c2ccc(Oc3ccccc3)cc2)c(=O)n1-c1ccccc1
Show InChI InChI=1S/C21H15N3O4/c25-19-22-20(26)24(21(27)23(19)15-7-3-1-4-8-15)16-11-13-18(14-12-16)28-17-9-5-2-6-10-17/h1-14H,(H,22,25,26)
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n/an/an/an/a 1.40E+3n/an/an/an/a



Usona Institute

Curated by ChEMBL


Assay Description
Agonist activity at TrkB (unknown origin) in expressed in U2OS cells incubated for 3 hrs and measured after 60 hrs in presence of BDNF by fluorescenc...


ACS Med Chem Lett 10: 1590-1591 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00506
BindingDB Entry DOI: 10.7270/Q2GM8BKZ
More data for this
Ligand-Target Pair