null

SMILES: CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC

InChI Key: InChIKey=JRNBIFGQRNWOKC-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 279095   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.40	n/a	n/a	n/a	n/a	7.6	25
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...				US Patent US10034861 (2018) BindingDB Entry DOI: 10.7270/Q2X350HN
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.510	n/a	n/a	n/a	n/a	7.6	25
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...				US Patent US10034861 (2018) BindingDB Entry DOI: 10.7270/Q2X350HN
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.40	n/a	n/a	n/a	n/a	7.6	25
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...				US Patent US10034861 (2018) BindingDB Entry DOI: 10.7270/Q2X350HN
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...				US Patent US10512632 (2019) BindingDB Entry DOI: 10.7270/Q25T3NVN
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.510	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...				US Patent US10512632 (2019) BindingDB Entry DOI: 10.7270/Q25T3NVN
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.40	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...				US Patent US10806718 (2020)
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...				US Patent US10766893 (2020)
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.510	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...				US Patent US10766893 (2020)
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.40	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays were performed in 60 μL samples containing a fixed amount of the PDE1 enzyme...				US Patent US10766893 (2020)
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...				US Patent US10806718 (2020)
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.510	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...				US Patent US10806718 (2020)
					More data for this Ligand-Target Pair
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C (Homo sapiens (Human))	BDBM279095 (5-(2-ethoxy-3-pyridyl)-N-[(2-methoxy-4-pyridyl)met...) Show SMILES CCOc1ncccc1-c1cc(NCc2ccnc(OC)c2)c2n(nc(C)c2n1)C(C)CC Show InChI InChI=1S/C25H30N6O2/c1-6-16(3)31-24-21(28-15-18-10-12-26-22(13-18)32-5)14-20(29-23(24)17(4)30-31)19-9-8-11-27-25(19)33-7-2/h8-14,16H,6-7,15H2,1-5H3,(H,28,29)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.40	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S US Patent					Assay Description PDE1A, PDE1B and PDE1C assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzyme ...				US Patent US10512632 (2019) BindingDB Entry DOI: 10.7270/Q25T3NVN
					More data for this Ligand-Target Pair