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Compile Data Set for Download or QSAR

Found 18 hits Enz. Inhib. hit(s) with all data for entry = 50036097   
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
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50368560
PNG
(CHEMBL1744254)
Show SMILES COc1ccc(cc1)S(=O)(=O)NC(=O)c1ccc(nc1)C([O-])=O
Show InChI InChI=1S/C14H12N2O6S/c1-22-10-3-5-11(6-4-10)23(20,21)16-13(17)9-2-7-12(14(18)19)15-8-9/h2-8H,1H3,(H,16,17)(H,18,19)/p-1
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n/an/a 1.00E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000409
PNG
(5-Benzenesulfonylaminocarbonyl-pyridine-2-carboxyl...)
Show SMILES OC(=O)c1ccc(cn1)C(=O)NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H10N2O5S/c16-12(9-6-7-11(13(17)18)14-8-9)15-21(19,20)10-4-2-1-3-5-10/h1-8H,(H,15,16)(H,17,18)
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n/an/a 1.10E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50368564
PNG
(CHEMBL1203805)
Show SMILES CC(C)S(=O)(=O)NC(=O)c1ccc(nc1)C(O)=O
Show InChI InChI=1S/C10H12N2O5S/c1-6(2)18(16,17)12-9(13)7-3-4-8(10(14)15)11-5-7/h3-6H,1-2H3,(H,12,13)(H,14,15)
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n/an/a 1.60E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50368562
PNG
(CHEMBL1744252)
Show SMILES [O-]C(=O)c1ccc(cn1)C(=O)[N-]S(=O)(=O)c1cccc2cccnc12
Show InChI InChI=1S/C16H11N3O5S/c20-15(11-6-7-12(16(21)22)18-9-11)19-25(23,24)13-5-1-3-10-4-2-8-17-14(10)13/h1-9H,(H2,19,20,21,22)/p-2
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n/an/a 1.80E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50368565
PNG
(CHEMBL1203806)
Show SMILES CS(=O)(=O)NC(=O)c1ccc(nc1)C(O)=O
Show InChI InChI=1S/C8H8N2O5S/c1-16(14,15)10-7(11)5-2-3-6(8(12)13)9-4-5/h2-4H,1H3,(H,10,11)(H,12,13)
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n/an/a 1.80E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50368561
PNG
(CHEMBL1744251)
Show SMILES [O-]C(=O)c1ccc(cn1)C(=O)[N-]S(=O)(=O)c1ccc(Cl)s1
Show InChI InChI=1S/C11H7ClN2O5S2/c12-8-3-4-9(20-8)21(18,19)14-10(15)6-1-2-7(11(16)17)13-5-6/h1-5H,(H2,14,15,16,17)/p-2
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n/an/a 2.40E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000400
PNG
(5-Phenylmethanesulfonylaminocarbonyl-pyridine-2-ca...)
Show SMILES OC(=O)c1ccc(cn1)C(=O)NS(=O)(=O)Cc1ccccc1
Show InChI InChI=1S/C14H12N2O5S/c17-13(11-6-7-12(14(18)19)15-8-11)16-22(20,21)9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)(H,18,19)
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n/an/a 3.00E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000416
PNG
(5-(Naphthalene-1-sulfonylaminocarbonyl)-pyridine-2...)
Show SMILES OC(=O)c1ccc(cn1)C(=O)NS(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C17H12N2O5S/c20-16(12-8-9-14(17(21)22)18-10-12)19-25(23,24)15-7-3-5-11-4-1-2-6-13(11)15/h1-10H,(H,19,20)(H,21,22)
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n/an/a 4.40E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM26114
PNG
(CHEMBL88972 | pyridine carboxylate, 6b | pyridine-...)
Show SMILES OC(=O)c1ccc(nc1)C(O)=O
Show InChI InChI=1S/C7H5NO4/c9-6(10)4-1-2-5(7(11)12)8-3-4/h1-3H,(H,9,10)(H,11,12)
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n/an/a 5.50E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50368563
PNG
(CHEMBL1744253)
Show SMILES [O-]C(=O)c1ccc(cn1)C(=O)[N-]S(=O)(=O)c1ccc(cc1)-c1cc(Cl)c2ccc(Cl)cc2n1
Show InChI InChI=1S/C22H13Cl2N3O5S/c23-14-4-7-16-17(24)10-19(26-20(16)9-14)12-1-5-15(6-2-12)33(31,32)27-21(28)13-3-8-18(22(29)30)25-11-13/h1-11H,(H2,27,28,29,30)/p-2
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n/an/a 6.60E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50368559
PNG
(CHEMBL1744255)
Show SMILES [O-]C(=O)c1ccc(cn1)C(=O)[N-]S(=O)(=O)c1cc(Br)c(Br)s1
Show InChI InChI=1S/C11H6Br2N2O5S2/c12-6-3-8(21-9(6)13)22(19,20)15-10(16)5-1-2-7(11(17)18)14-4-5/h1-4H,(H2,15,16,17,18)/p-2
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n/an/a 8.50E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000406
PNG
(5-(2-Carboxy-ethyl)-pyridine-2-carboxylic acid | C...)
Show SMILES OC(=O)CCc1ccc(nc1)C(O)=O
Show InChI InChI=1S/C9H9NO4/c11-8(12)4-2-6-1-3-7(9(13)14)10-5-6/h1,3,5H,2,4H2,(H,11,12)(H,13,14)
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n/an/a 9.60E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000414
PNG
(5-Carboxymethyl-pyridine-2-carboxylic acid | CHEMB...)
Show SMILES OC(=O)Cc1ccc(nc1)C(O)=O
Show InChI InChI=1S/C8H7NO4/c10-7(11)3-5-1-2-6(8(12)13)9-4-5/h1-2,4H,3H2,(H,10,11)(H,12,13)
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n/an/a 9.60E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000403
PNG
(5-(2-Carboxy-vinyl)-pyridine-2-carboxylic acid | C...)
Show SMILES OC(=O)\C=C\c1ccc(nc1)C(O)=O
Show InChI InChI=1S/C9H7NO4/c11-8(12)4-2-6-1-3-7(9(13)14)10-5-6/h1-5H,(H,11,12)(H,13,14)/b4-2+
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n/an/a 1.06E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000410
PNG
(5-(2-Benzenesulfonylamino-2-oxo-ethyl)-pyridine-2-...)
Show SMILES OC(=O)c1ccc(CC(=O)NS(=O)(=O)c2ccccc2)cn1
Show InChI InChI=1S/C14H12N2O5S/c17-13(8-10-6-7-12(14(18)19)15-9-10)16-22(20,21)11-4-2-1-3-5-11/h1-7,9H,8H2,(H,16,17)(H,18,19)
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n/an/a 1.70E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000402
PNG
(5-(1-Carboxy-2-phenyl-ethyl)-pyridine-2-carboxylic...)
Show SMILES OC(=O)C(Cc1ccccc1)c1ccc(nc1)C(O)=O
Show InChI InChI=1S/C15H13NO4/c17-14(18)12(8-10-4-2-1-3-5-10)11-6-7-13(15(19)20)16-9-11/h1-7,9,12H,8H2,(H,17,18)(H,19,20)
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n/an/a 2.70E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000407
PNG
(2-carboxypyridine | CHEMBL72628 | alpha-picolinic ...)
Show SMILES OC(=O)c1ccccn1
Show InChI InChI=1S/C6H5NO2/c8-6(9)5-3-1-2-4-7-5/h1-4H,(H,8,9)
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n/an/a 1.00E+5n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair
Transmembrane prolyl 4-hydroxylase


(Homo sapiens (Human))		BDBM50000413
PNG
(CHEMBL167326 | N-(Pyridine-2-carbonyl)-methanesulf...)
Show SMILES CS(=O)(=O)NC(=O)c1ccccn1
Show InChI InChI=1S/C7H8N2O3S/c1-13(11,12)9-7(10)6-4-2-3-5-8-6/h2-5H,1H3,(H,9,10)
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n/an/a 5.00E+5n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of prolyl 4-hydroxylase

J Med Chem 35: 800-4 (1992)


BindingDB Entry DOI: 10.7270/Q25T3M3C
More data for this
Ligand-Target Pair