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Compile Data Set for Download or QSAR

Found 12 hits Enz. Inhib. hit(s) with Target = 'Low affinity neurotrophin receptor p75NTR'   
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
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50180054
PNG
(CHEMBL199824 | [O-methyl-11C]2-{4-[4-(7-methoxynap...)
Show SMILES COc1ccc2cccc(N3CCN(CCCCn4ncc(=O)n(C)c4=O)CC3)c2c1
Show InChI InChI=1S/C23H29N5O3/c1-25-22(29)17-24-28(23(25)30)11-4-3-10-26-12-14-27(15-13-26)21-7-5-6-18-8-9-19(31-2)16-20(18)21/h5-9,16-17H,3-4,10-15H2,1-2H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Columbia University College of Physicians and Surgeons

Curated by ChEMBL


Assay Description
Binding affinity to neurotrophin receptor


J Med Chem 49: 125-34 (2006)


Article DOI: 10.1021/jm050725j
BindingDB Entry DOI: 10.7270/Q2R49QBD
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50182020
PNG
(2-(4-(4-(3-methoxyphenyl)piperazin-1-yl)butyl)-4-m...)
Show SMILES COc1cccc(c1)N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1
Show InChI InChI=1S/C19H27N5O3/c1-21-18(25)15-20-24(19(21)26)9-4-3-8-22-10-12-23(13-11-22)16-6-5-7-17(14-16)27-2/h5-7,14-15H,3-4,8-13H2,1-2H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Columbia University College of Physicians and Surgeons

Curated by ChEMBL


Assay Description
Binding affinity to NT by radioligand binding assay


Bioorg Med Chem Lett 16: 2101-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.052
BindingDB Entry DOI: 10.7270/Q2ZC82FS
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50029495
PNG
(7-Benzoylamino-4-methyl-9-oxo-4,9-dihydro-pyrazolo...)
Show SMILES Cn1c2cc(nn2c(=O)c2cc(NC(=O)c3ccccc3)ccc12)C(O)=O
Show InChI InChI=1S/C19H14N4O4/c1-22-15-8-7-12(20-17(24)11-5-3-2-4-6-11)9-13(15)18(25)23-16(22)10-14(21-23)19(26)27/h2-10H,1H3,(H,20,24)(H,26,27)
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n/an/a 200n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of [125I]- NGF binding to extracellular domain of p75 receptor


J Med Chem 38: 4439-45 (1995)


BindingDB Entry DOI: 10.7270/Q2W37V9R
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50029497
PNG
(2-Methyl-7-oxo-5-(tetrazol-1-ylcarbamoyl)-4,7-dihy...)
Show SMILES COC(=O)c1c(C)sc2c(O)cc(nc12)C(=O)Nn1cnnn1
Show InChI InChI=1S/C12H10N6O4S/c1-5-8(12(21)22-2)9-10(23-5)7(19)3-6(14-9)11(20)15-18-4-13-16-17-18/h3-4H,1-2H3,(H,14,19)(H,15,20)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of [125I]- NGF binding to extracellular domain of p75 receptor


J Med Chem 38: 4439-45 (1995)


BindingDB Entry DOI: 10.7270/Q2W37V9R
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50029494
PNG
(2-Methyl-7-oxo-4,7-dihydro-thieno[3,2-b]pyridine-3...)
Show SMILES COC(=O)c1c(C)sc2c(O)cc(nc12)C(O)=O
Show InChI InChI=1S/C11H9NO5S/c1-4-7(11(16)17-2)8-9(18-4)6(13)3-5(12-8)10(14)15/h3H,1-2H3,(H,12,13)(H,14,15)
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n/an/a 2.30E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of [125I]- NGF binding to extracellular domain of p75 receptor


J Med Chem 38: 4439-45 (1995)


BindingDB Entry DOI: 10.7270/Q2W37V9R
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50029496
PNG
(6-Amino-4-oxo-1,4-dihydro-quinoline-2-carboxylic a...)
Show SMILES Nc1ccc2nc(cc(O)c2c1)C(O)=O
Show InChI InChI=1S/C10H8N2O3/c11-5-1-2-7-6(3-5)9(13)4-8(12-7)10(14)15/h1-4H,11H2,(H,12,13)(H,14,15)
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n/an/a 3.10E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of [125I]- NGF binding to extracellular domain of p75 receptor


J Med Chem 38: 4439-45 (1995)


BindingDB Entry DOI: 10.7270/Q2W37V9R
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50111443
PNG
(2-(2-Hydroxy-ethylamino)-5-nitro-benzo[de]isoquino...)
Show SMILES OCCNN1C(=O)c2cccc3cc(cc(C1=O)c23)[N+]([O-])=O
Show InChI InChI=1S/C14H11N3O5/c18-5-4-15-16-13(19)10-3-1-2-8-6-9(17(21)22)7-11(12(8)10)14(16)20/h1-3,6-7,15,18H,4-5H2
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n/an/a 3.72E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Competitive binding against Nerve growth factor to p75-NGF receptor in PC12 cells


J Med Chem 45: 1543-58 (2002)


BindingDB Entry DOI: 10.7270/Q2CN74ND
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50029495
PNG
(7-Benzoylamino-4-methyl-9-oxo-4,9-dihydro-pyrazolo...)
Show SMILES Cn1c2cc(nn2c(=O)c2cc(NC(=O)c3ccccc3)ccc12)C(O)=O
Show InChI InChI=1S/C19H14N4O4/c1-22-15-8-7-12(20-17(24)11-5-3-2-4-6-11)9-13(15)18(25)23-16(22)10-14(21-23)19(26)27/h2-10H,1H3,(H,20,24)(H,26,27)
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n/an/a 1.10E+5n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of mouse NGF binding to p75 (unknown origin) by SPR method


J Med Chem 60: 66-88 (2017)


Article DOI: 10.1021/acs.jmedchem.6b00964
BindingDB Entry DOI: 10.7270/Q2C24ZCR
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50396070
PNG
(CHEMBL1397270)
Show SMILES Cc1cc2nc3c(nc(=O)[nH]c3=O)n(C)c2cc1C=O
Show InChI InChI=1S/C13H10N4O3/c1-6-3-8-9(4-7(6)5-18)17(2)11-10(14-8)12(19)16-13(20)15-11/h3-5H,1-2H3,(H,16,19,20)
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n/an/a 2.44E+5n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of mouse NGF binding to p75 (unknown origin) by SPR method


J Med Chem 60: 66-88 (2017)


Article DOI: 10.1021/acs.jmedchem.6b00964
BindingDB Entry DOI: 10.7270/Q2C24ZCR
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Homo sapiens (Human))
BDBM50111443
PNG
(2-(2-Hydroxy-ethylamino)-5-nitro-benzo[de]isoquino...)
Show SMILES OCCNN1C(=O)c2cccc3cc(cc(C1=O)c23)[N+]([O-])=O
Show InChI InChI=1S/C14H11N3O5/c18-5-4-15-16-13(19)10-3-1-2-8-6-9(17(21)22)7-11(12(8)10)14(16)20/h1-3,6-7,15,18H,4-5H2
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n/an/a>3.00E+5n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of mouse NGF binding to p75 (unknown origin) by SPR method


J Med Chem 60: 66-88 (2017)


Article DOI: 10.1021/acs.jmedchem.6b00964
BindingDB Entry DOI: 10.7270/Q2C24ZCR
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Mus musculus)
BDBM50535058
PNG
(CHEMBL4439582)
Show SMILES CCC(C)C(N)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C12H25N3O2/c1-3-10(2)11(13)12(16)14-4-5-15-6-8-17-9-7-15/h10-11H,3-9,13H2,1-2H3,(H,14,16)
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n/an/an/an/a 20n/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Activation of p75NTR in mouse hippocampal neurons assessed as increase in cell survival after 48 hrs by MTT assay


Bioorg Med Chem 24: 4759-4765 (2016)


Article DOI: 10.1016/j.bmc.2016.08.020
BindingDB Entry DOI: 10.7270/Q20K2D23
More data for this
Ligand-Target Pair
Tumor necrosis factor receptor superfamily member 16


(Mus musculus)
BDBM50535059
PNG
(CHEMBL4446977)
Show SMILES CN(C)CCCNC(=O)Cn1cnc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C14H22N6O3/c1-17(2)7-5-6-15-10(21)8-20-9-16-12-11(20)13(22)19(4)14(23)18(12)3/h9H,5-8H2,1-4H3,(H,15,21)
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n/an/an/an/a<10n/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Activation of p75NTR in C57BL/6 mouse brain assessed as suppression of carbachol-mediated persistant firing of entorhinal cortex after 15 mins by cur...


Bioorg Med Chem 24: 4759-4765 (2016)


Article DOI: 10.1016/j.bmc.2016.08.020
BindingDB Entry DOI: 10.7270/Q20K2D23
More data for this
Ligand-Target Pair