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BDBM50025787 1-(2,3-Dichloro-benzyl)-1,3-dihydro-imidazole-2-thione::CHEMBL294593

SMILES: Clc1cccc(Cn2cc[nH]c2=S)c1Cl

InChI Key: InChIKey=LVHGMHNWDAVLQN-UHFFFAOYSA-N

Data: 4 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50025787   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Dopamine beta-hydroxylase


(Bos taurus)
BDBM50025787
PNG
(1-(2,3-Dichloro-benzyl)-1,3-dihydro-imidazole-2-th...)
Show SMILES Clc1cccc(Cn2cc[nH]c2=S)c1Cl
Show InChI InChI=1S/C10H8Cl2N2S/c11-8-3-1-2-7(9(8)12)6-14-5-4-13-10(14)15/h1-5H,6H2,(H,13,15)
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PubMed
n/an/a 5.20E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory Concentration against bovine Dopamine beta hydroxylase (DBH); Range is between (37-70)


J Med Chem 30: 486-94 (1987)


BindingDB Entry DOI: 10.7270/Q2FJ2FSM
More data for this
Ligand-Target Pair
Dopamine beta-hydroxylase


(Homo sapiens (Human))
BDBM50025787
PNG
(1-(2,3-Dichloro-benzyl)-1,3-dihydro-imidazole-2-th...)
Show SMILES Clc1cccc(Cn2cc[nH]c2=S)c1Cl
Show InChI InChI=1S/C10H8Cl2N2S/c11-8-3-1-2-7(9(8)12)6-14-5-4-13-10(14)15/h1-5H,6H2,(H,13,15)
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n/an/a 5.25E+4n/an/an/an/an/an/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


(Homo sapiens (Human))
BDBM50025787
PNG
(1-(2,3-Dichloro-benzyl)-1,3-dihydro-imidazole-2-th...)
Show SMILES Clc1cccc(Cn2cc[nH]c2=S)c1Cl
Show InChI InChI=1S/C10H8Cl2N2S/c11-8-3-1-2-7(9(8)12)6-14-5-4-13-10(14)15/h1-5H,6H2,(H,13,15)
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Article
PubMed
n/an/a 5.25E+4n/an/an/an/an/an/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


(Rattus norvegicus)
BDBM50025787
PNG
(1-(2,3-Dichloro-benzyl)-1,3-dihydro-imidazole-2-th...)
Show SMILES Clc1cccc(Cn2cc[nH]c2=S)c1Cl
Show InChI InChI=1S/C10H8Cl2N2S/c11-8-3-1-2-7(9(8)12)6-14-5-4-13-10(14)15/h1-5H,6H2,(H,13,15)
KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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PubMed
n/an/a 5.25E+4n/an/an/an/an/an/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