Compile Data Set for Download or QSAR

Found 10 hits Enz. Inhib. hit(s) with Target = 'Phenylalanine-4-hydroxylase'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Phenylalanine-4-hydroxylase (Rattus norvegicus)	BDBM50028430 (2-Amino-6-phenyl-7,8-dihydro-3H,6H-pyrimido[5,4-b]...) Show SMILES Nc1nc2NCC(Sc2c(=O)[nH]1)c1ccccc1 Show InChI InChI=1S/C12H12N4OS/c13-12-15-10-9(11(17)16-12)18-8(6-14-10)7-4-2-1-3-5-7/h1-5,8H,6H2,(H4,13,14,15,16,17)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for competitive binding inhibition against phenylalanine hydroxylase in rat liver				J Med Chem 26: 559-63 (1983) BindingDB Entry DOI: 10.7270/Q2028QKN
					More data for this Ligand-Target Pair
Phenylalanine-4-hydroxylase (Rattus norvegicus)	BDBM50028428 (2,6-Diamino-5-phenylsulfanyl-3H-pyrimidin-4-one | ...) Show SMILES Nc1nc(N)c(Sc2ccccc2)c(=O)[nH]1 Show InChI InChI=1S/C10H10N4OS/c11-8-7(9(15)14-10(12)13-8)16-6-4-2-1-3-5-6/h1-5H,(H5,11,12,13,14,15)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for competitive binding inhibition against phenylalanine hydroxylase in rat liver				J Med Chem 26: 559-63 (1983) BindingDB Entry DOI: 10.7270/Q2028QKN
					More data for this Ligand-Target Pair
Phenylalanine-4-hydroxylase (Rattus norvegicus)	BDBM50028426 (2-Amino-5-oxo-6-phenyl-5,6,7,8-tetrahydro-3H-5lamb...) Show SMILES Nc1nc2NC=C(c3ccccc3)S(=O)c2c(=O)[nH]1 |t:5| Show InChI InChI=1S/C12H11N4O2S/c13-12-15-10-9(11(17)16-12)19(18)8(6-14-10)7-4-2-1-3-5-7/h1-6,18H,(H4,13,14,15,16,17)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for competitive binding inhibition against phenylalanine hydroxylase in rat liver				J Med Chem 26: 559-63 (1983) BindingDB Entry DOI: 10.7270/Q2028QKN
					More data for this Ligand-Target Pair
Phenylalanine-4-hydroxylase (Homo sapiens (Human))	BDBM50156156 (2-Amino-7-(1,2-dihydroxy-propyl)-5,6,7,8-tetrahydr...) Show SMILES CC(O)C(O)C1CNc2c(N1)nc(N)[nH]c2=O Show InChI InChI=1S/C9H15N5O3/c1-3(15)6(16)4-2-11-5-7(12-4)13-9(10)14-8(5)17/h3-4,6,11,15-16H,2H2,1H3,(H4,10,12,13,14,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bergen Curated by ChEMBL					Assay Description Binding affinity for human phenylalanine hydroxylase				J Med Chem 47: 5962-71 (2004) Article DOI: 10.1021/jm0497646 BindingDB Entry DOI: 10.7270/Q24F1Q63
					More data for this Ligand-Target Pair
Phenylalanine-4-hydroxylase (Rattus norvegicus)	BDBM50028425 (2-Amino-6-methyl-7,8-dihydro-3H,6H-pyrimido[5,4-b]...) Show SMILES CC1CNc2nc(N)[nH]c(=O)c2S1 Show InChI InChI=1S/C7H10N4OS/c1-3-2-9-5-4(13-3)6(12)11-7(8)10-5/h3H,2H2,1H3,(H4,8,9,10,11,12)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	3.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for competitive binding inhibition against phenylalanine hydroxylase in rat liver				J Med Chem 26: 559-63 (1983) BindingDB Entry DOI: 10.7270/Q2028QKN
					More data for this Ligand-Target Pair
Phenylalanine-4-hydroxylase (Rattus norvegicus)	BDBM50028424 (2-Amino-7,8-dihydro-3H,6H-pyrimido[5,4-b][1,4]thia...) Show SMILES Nc1nc2NCCSc2c(=O)[nH]1 Show InChI InChI=1S/C6H8N4OS/c7-6-9-4-3(5(11)10-6)12-2-1-8-4/h1-2H2,(H4,7,8,9,10,11)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for competitive binding inhibition against phenylalanine hydroxylase in rat liver				J Med Chem 26: 559-63 (1983) BindingDB Entry DOI: 10.7270/Q2028QKN
					More data for this Ligand-Target Pair
Phenylalanine-4-hydroxylase (Rattus norvegicus)	BDBM50028427 (2-Amino-6-methyl-5-oxo-5,6,7,8-tetrahydro-3H-5lamb...) Show SMILES CC1=CNc2nc(N)[nH]c(=O)c2S1=O |t:1| Show InChI InChI=1S/C7H9N4O2S/c1-3-2-9-5-4(14(3)13)6(12)11-7(8)10-5/h2,13H,1H3,(H4,8,9,10,11,12)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.25E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for competitive binding inhibition against phenylalanine hydroxylase in rat liver				J Med Chem 26: 559-63 (1983) BindingDB Entry DOI: 10.7270/Q2028QKN
					More data for this Ligand-Target Pair
Phenylalanine-4-hydroxylase (Rattus norvegicus)	BDBM50028431 (2-Amino-5-oxo-5,6,7,8-tetrahydro-3H-5lambda*4*-pyr...) Show SMILES Nc1nc2NC=CS(=O)c2c(=O)[nH]1 |c:5| Show InChI InChI=1S/C6H7N4O2S/c7-6-9-4-3(5(11)10-6)13(12)2-1-8-4/h1-2,12H,(H4,7,8,9,10,11)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for competitive binding inhibition against phenylalanine hydroxylase in rat liver				J Med Chem 26: 559-63 (1983) BindingDB Entry DOI: 10.7270/Q2028QKN
					More data for this Ligand-Target Pair
Phenylalanine-4-hydroxylase (Rattus norvegicus)	BDBM50028429 (2-Amino-3,5,6,7-tetrahydro-pyrimido[4,5-b][1,4]thi...) Show SMILES Nc1nc2SCCNc2c(=O)[nH]1 Show InChI InChI=1S/C6H8N4OS/c7-6-9-4(11)3-5(10-6)12-2-1-8-3/h8H,1-2H2,(H3,7,9,10,11)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for competitive binding inhibition against phenylalanine hydroxylase in rat liver				J Med Chem 26: 559-63 (1983) BindingDB Entry DOI: 10.7270/Q2028QKN
					More data for this Ligand-Target Pair
Phenylalanine-4-hydroxylase (Homo sapiens (Human))	BDBM50156156 (2-Amino-7-(1,2-dihydroxy-propyl)-5,6,7,8-tetrahydr...) Show SMILES CC(O)C(O)C1CNc2c(N1)nc(N)[nH]c2=O Show InChI InChI=1S/C9H15N5O3/c1-3(15)6(16)4-2-11-5-7(12-4)13-9(10)14-8(5)17/h3-4,6,11,15-16H,2H2,1H3,(H4,10,12,13,14,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bergen Curated by ChEMBL					Assay Description Inhibitory concentration against human phenylalanine hydroxylase				J Med Chem 47: 5962-71 (2004) Article DOI: 10.1021/jm0497646 BindingDB Entry DOI: 10.7270/Q24F1Q63
					More data for this Ligand-Target Pair