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PubMed code 16246562

Compile data set for download or QSAR
Found 4 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
Cytochrome P450 11B2 (CYP11B2)


(Homo sapiens (Human))
BDBM9921
PNG
(3-(1,2-dihydroacenaphthylen-3-yl)pyridine | acenap...)
Show SMILES C1Cc2c(ccc3cccc1c23)-c1cccnc1
Show InChI InChI=1S/C17H13N/c1-3-12-6-8-15(14-5-2-10-18-11-14)16-9-7-13(4-1)17(12)16/h1-6,8,10-11H,7,9H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 10n/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Bioorg Med Chem Lett 16: 25-30 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.059
BindingDB Entry DOI: 10.7270/Q2F18WXW
More data for this
Ligand-Target Pair
Cytochrome P450 11B2 (CYP11B2)


(Homo sapiens (Human))
BDBM9922
PNG
(3-(1,2-dihydroacenaphthylen-5-yl)pyridine | acenap...)
Show SMILES C1Cc2ccc(-c3cccnc3)c3cccc1c23
Show InChI InChI=1S/C17H13N/c1-3-12-6-7-13-8-9-15(16(5-1)17(12)13)14-4-2-10-18-11-14/h1-5,8-11H,6-7H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 14n/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Bioorg Med Chem Lett 16: 25-30 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.059
BindingDB Entry DOI: 10.7270/Q2F18WXW
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))
BDBM9921
PNG
(3-(1,2-dihydroacenaphthylen-3-yl)pyridine | acenap...)
Show SMILES C1Cc2c(ccc3cccc1c23)-c1cccnc1
Show InChI InChI=1S/C17H13N/c1-3-12-6-8-15(14-5-2-10-18-11-14)16-9-7-13(4-1)17(12)16/h1-6,8,10-11H,7,9H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 2.45E+3n/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Bioorg Med Chem Lett 16: 25-30 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.059
BindingDB Entry DOI: 10.7270/Q2F18WXW
More data for this
Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial


(Homo sapiens (Human))
BDBM9922
PNG
(3-(1,2-dihydroacenaphthylen-5-yl)pyridine | acenap...)
Show SMILES C1Cc2ccc(-c3cccnc3)c3cccc1c23
Show InChI InChI=1S/C17H13N/c1-3-12-6-7-13-8-9-15(16(5-1)17(12)13)14-4-2-10-18-11-14/h1-5,8-11H,6-7H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.90E+3n/an/an/an/a7.437



Saarland University



Assay Description
The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...


Bioorg Med Chem Lett 16: 25-30 (2006)


Article DOI: 10.1016/j.bmcl.2005.09.059
BindingDB Entry DOI: 10.7270/Q2F18WXW
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%