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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A/1B/1C' and Ligand = 'BDBM50018624'   
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
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A/1B/1C


(Homo sapiens (Human))
BDBM50018624
PNG
(6-[4-(4,5,6,7-Tetrahydro-benzoimidazol-1-yl)-pheny...)
Show SMILES O=C1CCC(=NN1)c1ccc(cc1)-n1cnc2CCCCc12 |c:4|
Show InChI InChI=1S/C17H18N4O/c22-17-10-9-14(19-20-17)12-5-7-13(8-6-12)21-11-18-15-3-1-2-4-16(15)21/h5-8,11H,1-4,9-10H2,(H,20,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 1.40E+5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against cAMP PDE II enzyme in guinea pig


J Med Chem 30: 1955-62 (1987)


BindingDB Entry DOI: 10.7270/Q27S7MS4
More data for this
Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A/1B/1C


(Homo sapiens (Human))
BDBM50018624
PNG
(6-[4-(4,5,6,7-Tetrahydro-benzoimidazol-1-yl)-pheny...)
Show SMILES O=C1CCC(=NN1)c1ccc(cc1)-n1cnc2CCCCc12 |c:4|
Show InChI InChI=1S/C17H18N4O/c22-17-10-9-14(19-20-17)12-5-7-13(8-6-12)21-11-18-15-3-1-2-4-16(15)21/h5-8,11H,1-4,9-10H2,(H,20,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 1.80E+5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against cAMP PDE I enzyme in guinea pig


J Med Chem 30: 1955-62 (1987)


BindingDB Entry DOI: 10.7270/Q27S7MS4
More data for this
Ligand-Target Pair