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PubMed code 17548197

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
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
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50214842
PNG
(4-amino-2-butyl-6-phenyl-5-vinylpyridazin-3(2H)-on...)
Show SMILES CCCCn1nc(-c2ccccc2)c(C=C)c(N)c1=O
Show InChI InChI=1S/C16H19N3O/c1-3-5-11-19-16(20)14(17)13(4-2)15(18-19)12-9-7-6-8-10-12/h4,6-10H,2-3,5,11,17H2,1H3
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PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Dipartimento di Scienze Farmaceutiche

Curated by ChEMBL


Assay Description
Binding affinity to mu opioid receptor


Bioorg Med Chem 15: 5563-75 (2007)


Article DOI: 10.1016/j.bmc.2007.05.035
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50214842
PNG
(4-amino-2-butyl-6-phenyl-5-vinylpyridazin-3(2H)-on...)
Show SMILES CCCCn1nc(-c2ccccc2)c(C=C)c(N)c1=O
Show InChI InChI=1S/C16H19N3O/c1-3-5-11-19-16(20)14(17)13(4-2)15(18-19)12-9-7-6-8-10-12/h4,6-10H,2-3,5,11,17H2,1H3
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UniProtKB/SwissProt

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antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Dipartimento di Scienze Farmaceutiche

Curated by ChEMBL


Assay Description
Binding affinity to kappa opioid receptor


Bioorg Med Chem 15: 5563-75 (2007)


Article DOI: 10.1016/j.bmc.2007.05.035
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50214842
PNG
(4-amino-2-butyl-6-phenyl-5-vinylpyridazin-3(2H)-on...)
Show SMILES CCCCn1nc(-c2ccccc2)c(C=C)c(N)c1=O
Show InChI InChI=1S/C16H19N3O/c1-3-5-11-19-16(20)14(17)13(4-2)15(18-19)12-9-7-6-8-10-12/h4,6-10H,2-3,5,11,17H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Dipartimento di Scienze Farmaceutiche

Curated by ChEMBL


Assay Description
Binding affinity to delta opioid receptor


Bioorg Med Chem 15: 5563-75 (2007)


Article DOI: 10.1016/j.bmc.2007.05.035
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%