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2 similar compounds to monomer 50016897

Compile data set for download or QSAR
Wt: 230.0
BDBM14062
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Wt: 245.1
BDBM50021812
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 14062,50021812   
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
Alpha-2A adrenergic receptor


(Homo sapiens (Human))
BDBM50021812
PNG
(2,6-Dichloro-N-imidazolidin-2-ylidene-benzene-1,4-...)
Show SMILES Nc1cc(Cl)c(N=C2NCCN2)c(Cl)c1
Show InChI InChI=1S/C9H10Cl2N4/c10-6-3-5(12)4-7(11)8(6)15-9-13-1-2-14-9/h3-4H,1-2,12H2,(H2,13,14,15)
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PubMed
2.90n/an/an/an/an/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested in vitro for binding affinity against Alpha-2A adrenergic receptor from cloned human C-10 receptor transfected into Chinese hamst...


J Med Chem 39: 3533-8 (1996)


Article DOI: 10.1021/jm960359r
BindingDB Entry DOI: 10.7270/Q2PC31GF
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(NEONATAL RAT)
BDBM50021812
PNG
(2,6-Dichloro-N-imidazolidin-2-ylidene-benzene-1,4-...)
Show SMILES Nc1cc(Cl)c(N=C2NCCN2)c(Cl)c1
Show InChI InChI=1S/C9H10Cl2N4/c10-6-3-5(12)4-7(11)8(6)15-9-13-1-2-14-9/h3-4H,1-2,12H2,(H2,13,14,15)
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UniProtKB/SwissProt

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PubMed
4.80n/an/an/an/an/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested in vitro for binding affinity against Alpha-2B adrenergic receptor from cloned rat RNG receptor transfected into Chinese hamster ...


J Med Chem 39: 3533-8 (1996)


Article DOI: 10.1021/jm960359r
BindingDB Entry DOI: 10.7270/Q2PC31GF
More data for this
Ligand-Target Pair
Alpha-2C adrenergic receptor


(Homo sapiens (Human))
BDBM50021812
PNG
(2,6-Dichloro-N-imidazolidin-2-ylidene-benzene-1,4-...)
Show SMILES Nc1cc(Cl)c(N=C2NCCN2)c(Cl)c1
Show InChI InChI=1S/C9H10Cl2N4/c10-6-3-5(12)4-7(11)8(6)15-9-13-1-2-14-9/h3-4H,1-2,12H2,(H2,13,14,15)
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UniProtKB/TrEMBL

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PubMed
30n/an/an/an/an/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested in vitro for binding affinity against Alpha-2C adrenergic receptor from cloned human C-2 receptor transfected into Chinese hamste...


J Med Chem 39: 3533-8 (1996)


Article DOI: 10.1021/jm960359r
BindingDB Entry DOI: 10.7270/Q2PC31GF
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50021812
PNG
(2,6-Dichloro-N-imidazolidin-2-ylidene-benzene-1,4-...)
Show SMILES Nc1cc(Cl)c(N=C2NCCN2)c(Cl)c1
Show InChI InChI=1S/C9H10Cl2N4/c10-6-3-5(12)4-7(11)8(6)15-9-13-1-2-14-9/h3-4H,1-2,12H2,(H2,13,14,15)
KEGG

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UniProtKB/TrEMBL

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n/an/a 4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]p-aminoclonidine (PAC) binding to alpha-2 adrenergic receptor of purified human platelet plasma membranes


J Med Chem 30: 1241-4 (1987)


Article DOI: 10.1021/jm00390a021
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM14062
PNG
(Clonidine | N-(2,6-dichlorophenyl)imidazolidin-2-i...)
Show SMILES Clc1cccc(Cl)c1N=C1NCCN1
Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)
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PDB
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n/an/a>2.00E+4n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against norepinephrine (NE) uptake in rat whole brain synaptosome preparation


J Med Chem 39: 570-81 (1996)


Article DOI: 10.1021/jm9506433
BindingDB Entry DOI: 10.7270/Q2BR8R7K
More data for this
Ligand-Target Pair