BDBM50014968 1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thione::4-(2-Mercapto-imidazol-1-ylmethyl)-phenol::CHEMBL164747
SMILES: Oc1ccc(Cn2cc[nH]c2=S)cc1
InChI Key: InChIKey=WVWZHFJGVDNBDA-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
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Dopamine beta-hydroxylase (Bos taurus) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 55 | n/a | n/a | n/a | n/a | n/a | n/a | 4.5 | n/a |
TBA Curated by ChEMBL | Assay Description Compound was evaluated for the inhibition of Dopamine beta hydroxylase at pH 4.5 | J Med Chem 29: 2465-72 (1987) BindingDB Entry DOI: 10.7270/Q2BR8R5P | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine beta-hydroxylase (Bos taurus) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 55 | n/a | n/a | n/a | n/a | n/a | n/a | 4.5 | n/a |
TBA Curated by ChEMBL | Assay Description Binding affinity towards Dopamine beta hydroxylase using tyramine substrate at pH 4.5 in the absence of fumarate | J Med Chem 29: 887-9 (1986) BindingDB Entry DOI: 10.7270/Q2JH3K55 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine beta-hydroxylase (Bos taurus) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 344 | n/a | n/a | n/a | n/a | n/a | n/a | 6.6 | n/a |
TBA Curated by ChEMBL | Assay Description Compound was evaluated for the inhibition of Dopamine beta hydroxylase at pH 6.6 | J Med Chem 29: 2465-72 (1987) BindingDB Entry DOI: 10.7270/Q2BR8R5P | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine beta-hydroxylase (Rattus norvegicus) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 2.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois Curated by ChEMBL | Assay Description Inhibition of dopamine beta-hydroxylase (DbetaH) in hypertensive rats when administered orally (or) intraperitoneally | J Med Chem 33: 274-81 (1990) BindingDB Entry DOI: 10.7270/Q26Q1ZD2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine beta-hydroxylase (Homo sapiens (Human)) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Harvard University Curated by ChEMBL | Assay Description Inhibition of dopamine beta-hydroxylase (DbetaH) enzyme | J Med Chem 40: 4360-71 (1998) Article DOI: 10.1021/jm970488n BindingDB Entry DOI: 10.7270/Q2BZ6784 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine beta-hydroxylase (Homo sapiens (Human)) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 2.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Molecular Simulations Inc Curated by ChEMBL | Assay Description Inhibition of dopamine beta hydroxylase | J Med Chem 38: 2091-102 (1995) BindingDB Entry DOI: 10.7270/Q2W37XH8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine beta-hydroxylase (Rattus norvegicus) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of Dopamine beta hydroxylase in spontaneously hypertensive rats; Value ranges from 1.3-4.6 | J Med Chem 30: 1309-13 (1987) BindingDB Entry DOI: 10.7270/Q2MC8Z0M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine beta-hydroxylase (Bos taurus) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of Dopamine beta hydroxylase. | J Med Chem 29: 2465-72 (1987) BindingDB Entry DOI: 10.7270/Q2BR8R5P | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine beta-hydroxylase (Bos taurus) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Smith Kline & French Laboratories Curated by ChEMBL | Assay Description Inhibitory activity was determined against bovine dopamine beta-hydroxylase(DBH) | J Med Chem 33: 781-9 (1990) BindingDB Entry DOI: 10.7270/Q2DZ078G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine beta-hydroxylase (Bos taurus) | BDBM50014968 (1-(4-Hydroxy-benzyl)-1,3-dihydro-imidazole-2-thion...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibitory Concentration against bovine Dopamine beta hydroxylase (DBH); Range is between (1.3-4.6) | J Med Chem 30: 486-94 (1987) BindingDB Entry DOI: 10.7270/Q2FJ2FSM | |||||||||||
More data for this Ligand-Target Pair |