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PubMed code 11689087

Compile data set for download or QSAR
Found 26 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
Insulin-like growth factor-binding protein 4


(Homo sapiens (Human))
BDBM50106431
PNG
(1-(3,4-Dihydroxy-benzoyl)-6,7-dihydroxy-isoquinoli...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C17H11NO7/c19-11-2-1-7(4-12(11)20)16(23)15-9-6-14(22)13(21)5-8(9)3-10(18-15)17(24)25/h1-6,19-22H,(H,24,25)
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1n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against Insulin-like growth factor binding protein 4


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 2


(Homo sapiens (Human))
BDBM50106431
PNG
(1-(3,4-Dihydroxy-benzoyl)-6,7-dihydroxy-isoquinoli...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C17H11NO7/c19-11-2-1-7(4-12(11)20)16(23)15-9-6-14(22)13(21)5-8(9)3-10(18-15)17(24)25/h1-6,19-22H,(H,24,25)
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2.10n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against insulin-like growth factor binding protein 2


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 1


(Homo sapiens (Human))
BDBM50106431
PNG
(1-(3,4-Dihydroxy-benzoyl)-6,7-dihydroxy-isoquinoli...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C17H11NO7/c19-11-2-1-7(4-12(11)20)16(23)15-9-6-14(22)13(21)5-8(9)3-10(18-15)17(24)25/h1-6,19-22H,(H,24,25)
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5.10n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against insulin-like growth factor binding protein 1


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 5


(Homo sapiens (Human))
BDBM50106431
PNG
(1-(3,4-Dihydroxy-benzoyl)-6,7-dihydroxy-isoquinoli...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C17H11NO7/c19-11-2-1-7(4-12(11)20)16(23)15-9-6-14(22)13(21)5-8(9)3-10(18-15)17(24)25/h1-6,19-22H,(H,24,25)
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5.20n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against Insulin-like growth factor binding protein 5


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106431
PNG
(1-(3,4-Dihydroxy-benzoyl)-6,7-dihydroxy-isoquinoli...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C17H11NO7/c19-11-2-1-7(4-12(11)20)16(23)15-9-6-14(22)13(21)5-8(9)3-10(18-15)17(24)25/h1-6,19-22H,(H,24,25)
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5.60n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 4


(Homo sapiens (Human))
BDBM50106432
PNG
((3,4-Dihydroxy-phenyl)-(3,6,7-trihydroxy-isoquinol...)
Show SMILES Oc1ccc(cc1O)C(=O)c1[nH]c(=O)cc2cc(O)c(O)cc12
Show InChI InChI=1S/C16H11NO6/c18-10-2-1-7(3-11(10)19)16(23)15-9-6-13(21)12(20)4-8(9)5-14(22)17-15/h1-6,18-21H,(H,17,22)
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6.20n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against Insulin-like growth factor binding protein 4


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106443
PNG
(1-(3,4-Dihydroxy-benzyl)-6,7-dihydroxy-isoquinolin...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(Cc2ccc(O)c(O)c2)n1
Show InChI InChI=1S/C17H13NO6/c19-13-2-1-8(4-14(13)20)3-11-10-7-16(22)15(21)6-9(10)5-12(18-11)17(23)24/h1-2,4-7,19-22H,3H2,(H,23,24)
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7.5n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106446
PNG
(6,7-Dihydroxy-1-(naphthalene-2-carbonyl)-isoquinol...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H13NO5/c23-17-9-14-8-16(21(26)27)22-19(15(14)10-18(17)24)20(25)13-6-5-11-3-1-2-4-12(11)7-13/h1-10,23-24H,(H,26,27)
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13n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 2


(Homo sapiens (Human))
BDBM50106432
PNG
((3,4-Dihydroxy-phenyl)-(3,6,7-trihydroxy-isoquinol...)
Show SMILES Oc1ccc(cc1O)C(=O)c1[nH]c(=O)cc2cc(O)c(O)cc12
Show InChI InChI=1S/C16H11NO6/c18-10-2-1-7(3-11(10)19)16(23)15-9-6-13(21)12(20)4-8(9)5-14(22)17-15/h1-6,18-21H,(H,17,22)
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17n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against insulin-like growth factor binding protein 2


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 5


(Homo sapiens (Human))
BDBM50106432
PNG
((3,4-Dihydroxy-phenyl)-(3,6,7-trihydroxy-isoquinol...)
Show SMILES Oc1ccc(cc1O)C(=O)c1[nH]c(=O)cc2cc(O)c(O)cc12
Show InChI InChI=1S/C16H11NO6/c18-10-2-1-7(3-11(10)19)16(23)15-9-6-13(21)12(20)4-8(9)5-14(22)17-15/h1-6,18-21H,(H,17,22)
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21n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against Insulin-like growth factor binding protein 5


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 6


(Homo sapiens (Human))
BDBM50106431
PNG
(1-(3,4-Dihydroxy-benzoyl)-6,7-dihydroxy-isoquinoli...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C17H11NO7/c19-11-2-1-7(4-12(11)20)16(23)15-9-6-14(22)13(21)5-8(9)3-10(18-15)17(24)25/h1-6,19-22H,(H,24,25)
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24n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against Insulin-like growth factor binding protein 6


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106439
PNG
(6,7-Dihydroxy-1-(naphthalene-1-carbonyl)-isoquinol...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C21H13NO5/c23-17-9-12-8-16(21(26)27)22-19(15(12)10-18(17)24)20(25)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,23-24H,(H,26,27)
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27n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106432
PNG
((3,4-Dihydroxy-phenyl)-(3,6,7-trihydroxy-isoquinol...)
Show SMILES Oc1ccc(cc1O)C(=O)c1[nH]c(=O)cc2cc(O)c(O)cc12
Show InChI InChI=1S/C16H11NO6/c18-10-2-1-7(3-11(10)19)16(23)15-9-6-13(21)12(20)4-8(9)5-14(22)17-15/h1-6,18-21H,(H,17,22)
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28n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106441
PNG
(1-(3,4-Dihydroxy-benzyl)-isoquinoline-3,6,7-triol ...)
Show SMILES Oc1ccc(Cc2[nH]c(=O)cc3cc(O)c(O)cc23)cc1O
Show InChI InChI=1S/C16H13NO5/c18-12-2-1-8(4-13(12)19)3-11-10-7-15(21)14(20)5-9(10)6-16(22)17-11/h1-2,4-7,18-21H,3H2,(H,17,22)
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29n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 1


(Homo sapiens (Human))
BDBM50106432
PNG
((3,4-Dihydroxy-phenyl)-(3,6,7-trihydroxy-isoquinol...)
Show SMILES Oc1ccc(cc1O)C(=O)c1[nH]c(=O)cc2cc(O)c(O)cc12
Show InChI InChI=1S/C16H11NO6/c18-10-2-1-7(3-11(10)19)16(23)15-9-6-13(21)12(20)4-8(9)5-14(22)17-15/h1-6,18-21H,(H,17,22)
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34n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against insulin-like growth factor binding protein 1


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106433
PNG
(1-(2,4-Dichloro-benzoyl)-6,7-dihydroxy-isoquinolin...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C17H9Cl2NO5/c18-8-1-2-9(11(19)5-8)16(23)15-10-6-14(22)13(21)4-7(10)3-12(20-15)17(24)25/h1-6,21-22H,(H,24,25)
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44n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106436
PNG
((6,7-Dihydroxy-isoquinolin-1-yl)-(3,4-dihydroxy-ph...)
Show SMILES Oc1ccc(cc1O)C(=O)c1nccc2cc(O)c(O)cc12
Show InChI InChI=1S/C16H11NO5/c18-11-2-1-9(6-12(11)19)16(22)15-10-7-14(21)13(20)5-8(10)3-4-17-15/h1-7,18-21H
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58n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106437
PNG
(5-Bromo-1-(3,4-dihydroxy-benzoyl)-6-hydroxy-7-meth...)
Show SMILES COc1cc2c(nc(cc2c(Br)c1O)C(O)=O)C(=O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C18H12BrNO7/c1-27-13-6-9-8(14(19)17(13)24)5-10(18(25)26)20-15(9)16(23)7-2-3-11(21)12(22)4-7/h2-6,21-22,24H,1H3,(H,25,26)
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70n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106438
PNG
(1-(Benzo[1,3]dioxole-5-carbonyl)-6,7-dihydroxy-iso...)
Show SMILES OC(=O)c1cc2cc(O)c(O)cc2c(n1)C(=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C18H11NO7/c20-12-4-9-3-11(18(23)24)19-16(10(9)6-13(12)21)17(22)8-1-2-14-15(5-8)26-7-25-14/h1-6,20-21H,7H2,(H,23,24)
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70n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 6


(Homo sapiens (Human))
BDBM50106432
PNG
((3,4-Dihydroxy-phenyl)-(3,6,7-trihydroxy-isoquinol...)
Show SMILES Oc1ccc(cc1O)C(=O)c1[nH]c(=O)cc2cc(O)c(O)cc12
Show InChI InChI=1S/C16H11NO6/c18-10-2-1-7(3-11(10)19)16(23)15-9-6-13(21)12(20)4-8(9)5-14(22)17-15/h1-6,18-21H,(H,17,22)
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85n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity against Insulin-like growth factor binding protein 6


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106440
PNG
(8-Bromo-1-(3,4-dihydroxy-benzoyl)-7-hydroxy-6-meth...)
Show SMILES COc1cc2cc(nc(C(=O)c3ccc(O)c(O)c3)c2c(Br)c1O)C(O)=O
Show InChI InChI=1S/C18H12BrNO7/c1-27-12-6-8-4-9(18(25)26)20-15(13(8)14(19)17(12)24)16(23)7-2-3-10(21)11(22)5-7/h2-6,21-22,24H,1H3,(H,25,26)
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140n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106435
PNG
(7-Hydroxy-1-(3-hydroxy-4-methoxy-benzoyl)-6-methox...)
Show SMILES COc1ccc(cc1O)C(=O)c1nc(cc2cc(OC)c(O)cc12)C(O)=O
Show InChI InChI=1S/C19H15NO7/c1-26-15-4-3-9(6-13(15)21)18(23)17-11-8-14(22)16(27-2)7-10(11)5-12(20-17)19(24)25/h3-8,21-22H,1-2H3,(H,24,25)
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320n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106444
PNG
(1-(3-Hydroxy-4-methoxy-benzoyl)-6,7-dimethoxy-isoq...)
Show SMILES COc1ccc(cc1O)C(=O)c1nc(cc2cc(OC)c(OC)cc12)C(O)=O
Show InChI InChI=1S/C20H17NO7/c1-26-15-5-4-10(7-14(15)22)19(23)18-12-9-17(28-3)16(27-2)8-11(12)6-13(21-18)20(24)25/h4-9,22H,1-3H3,(H,24,25)
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>1.00E+4n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106434
PNG
(1-(3,4-Dimethoxy-benzoyl)-6,7-dimethoxy-isoquinoli...)
Show SMILES CCOC(=O)c1cc2cc(OC)c(OC)cc2c(n1)C(=O)c1ccc(OC)c(OC)c1
Show InChI InChI=1S/C23H23NO7/c1-6-31-23(26)16-9-14-11-19(29-4)20(30-5)12-15(14)21(24-16)22(25)13-7-8-17(27-2)18(10-13)28-3/h7-12H,6H2,1-5H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106442
PNG
(1-(3,4-Dihydroxy-benzoyl)-6,7-dimethoxy-isoquinoli...)
Show SMILES COc1cc2cc(nc(C(=O)c3ccc(O)c(O)c3)c2cc1OC)C(O)=O
Show InChI InChI=1S/C19H15NO7/c1-26-15-7-10-5-12(19(24)25)20-17(11(10)8-16(15)27-2)18(23)9-3-4-13(21)14(22)6-9/h3-8,21-22H,1-2H3,(H,24,25)
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>1.00E+4n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
Insulin-like growth factor-binding protein 3


(Homo sapiens (Human))
BDBM50106445
PNG
((3,4-Dimethoxy-phenyl)-(3-hydroxy-6,7-dimethoxy-is...)
Show SMILES COc1ccc(cc1OC)C(=O)c1[nH]c(=O)cc2cc(OC)c(OC)cc12
Show InChI InChI=1S/C20H19NO6/c1-24-14-6-5-11(7-15(14)25-2)20(23)19-13-10-17(27-4)16(26-3)8-12(13)9-18(22)21-19/h5-10H,1-4H3,(H,21,22)
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>1.00E+4n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Insulin-like growth factor binding protein 3


J Med Chem 44: 4001-10 (2001)


BindingDB Entry DOI: 10.7270/Q2F18Z12
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%