Compile Data Set for Download or QSAR

Found 20 hits Enz. Inhib. hit(s) with all data for entry = 50033519   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Calmodulin-1 (Human)	BDBM50346822 (CHEMBL66917) Show SMILES COc1ccc(CCc2cc(O)cc(OC)c2)cc1 Show InChI InChI=1S/C16H18O3/c1-18-15-7-5-12(6-8-15)3-4-13-9-14(17)11-16(10-13)19-2/h5-11,17H,3-4H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50001888 ((chloropromazine) [3-(2-Chloro-phenothiazin-10-yl)...) Show SMILES CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12 Show InChI InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346811 (CHEMBL1796022) Show SMILES C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C13H12/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-10H,11H2	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346820 (CHEMBL1796013) Show SMILES CCOc1ccc(CCc2cc(OC)cc(OC)c2)cc1OC Show InChI InChI=1S/C19H24O4/c1-5-23-18-9-8-14(12-19(18)22-4)6-7-15-10-16(20-2)13-17(11-15)21-3/h8-13H,5-7H2,1-4H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346810 (CHEMBL268559) Show SMILES COc1ccc(\C=C\C(=O)c2ccc(O)cc2)cc1 Show InChI InChI=1S/C16H14O3/c1-19-15-9-2-12(3-10-15)4-11-16(18)13-5-7-14(17)8-6-13/h2-11,17H,1H3/b11-4+	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346806 (CHEMBL1796026) Show SMILES Oc1cccc(CCCc2ccc3OCOc3c2)c1 Show InChI InChI=1S/C16H16O3/c17-14-6-2-5-12(9-14)3-1-4-13-7-8-15-16(10-13)19-11-18-15/h2,5-10,17H,1,3-4,11H2	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346819 (CHEMBL1796014) Show SMILES COc1cc(O)cc(CCc2ccc(cc2)N(C)C)c1 Show InChI InChI=1S/C17H21NO2/c1-18(2)15-8-6-13(7-9-15)4-5-14-10-16(19)12-17(11-14)20-3/h6-12,19H,4-5H2,1-3H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346821 (CHEMBL1796012) Show SMILES COc1cc(O)cc(CCc2ccc3OCOc3c2)c1 Show InChI InChI=1S/C16H16O4/c1-18-14-7-12(6-13(17)9-14)3-2-11-4-5-15-16(8-11)20-10-19-15/h4-9,17H,2-3,10H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346805 (CHEMBL1796027) Show SMILES COc1cc(O)cc(CCCc2ccc(O)c(OC)c2)c1 Show InChI InChI=1S/C17H20O4/c1-20-15-9-13(8-14(18)11-15)5-3-4-12-6-7-16(19)17(10-12)21-2/h6-11,18-19H,3-5H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346818 (CHEMBL1796015) Show SMILES COc1cc(CCc2ccc(cc2)N(C)C)cc(OC)c1 Show InChI InChI=1S/C18H23NO2/c1-19(2)16-9-7-14(8-10-16)5-6-15-11-17(20-3)13-18(12-15)21-4/h7-13H,5-6H2,1-4H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346809 (CHEMBL1796023) Show SMILES COc1cc(O)cc(c1)C(=O)\C=C\c1ccc(OC)c(O)c1 Show InChI InChI=1S/C17H16O5/c1-21-14-9-12(8-13(18)10-14)15(19)5-3-11-4-6-17(22-2)16(20)7-11/h3-10,18,20H,1-2H3/b5-3+	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346815 (CHEMBL1796017) Show SMILES CCOc1ccc(CCc2cccc(O)c2)cc1OC Show InChI InChI=1S/C17H20O3/c1-3-20-16-10-9-14(12-17(16)19-2)8-7-13-5-4-6-15(18)11-13/h4-6,9-12,18H,3,7-8H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.61E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346814 (CHEMBL1796018) Show SMILES CCOc1ccc(CCc2cc(O)cc(OC)c2)cc1OC Show InChI InChI=1S/C18H22O4/c1-4-22-17-8-7-13(11-18(17)21-3)5-6-14-9-15(19)12-16(10-14)20-2/h7-12,19H,4-6H2,1-3H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346812 (CHEMBL1796021) Show SMILES COc1cc(Cc2ccc(O)c(OC)c2)cc(OC)c1 Show InChI InChI=1S/C16H18O4/c1-18-13-7-12(8-14(10-13)19-2)6-11-4-5-15(17)16(9-11)20-3/h4-5,7-10,17H,6H2,1-3H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346813 (CHEMBL1796020) Show SMILES COc1cc(Cc2cccc(OC)c2O)cc(OC)c1 Show InChI InChI=1S/C16H18O4/c1-18-13-8-11(9-14(10-13)19-2)7-12-5-4-6-15(20-3)16(12)17/h4-6,8-10,17H,7H2,1-3H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.62E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346808 (CHEMBL1796024) Show SMILES COc1cc(O)cc(c1)C(=O)\C=C\c1ccc(O)c(OC)c1 Show InChI InChI=1S/C17H16O5/c1-21-14-9-12(8-13(18)10-14)15(19)5-3-11-4-6-16(20)17(7-11)22-2/h3-10,18,20H,1-2H3/b5-3+	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.73E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346807 (CHEMBL1796025) Show SMILES COc1ccc(CCCc2ccc(O)cc2)cc1 Show InChI InChI=1S/C16H18O2/c1-18-16-11-7-14(8-12-16)4-2-3-13-5-9-15(17)10-6-13/h5-12,17H,2-4H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.27E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346817 (CHEMBL1796016) Show SMILES Oc1cccc(CCc2ccc3OCOc3c2)c1 Show InChI InChI=1S/C15H14O3/c16-13-3-1-2-11(8-13)4-5-12-6-7-14-15(9-12)18-10-17-14/h1-3,6-9,16H,4-5,10H2	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.59E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346823 (GIGANTOL) Show SMILES COc1cc(O)cc(CCc2ccc(O)c(OC)c2)c1 Show InChI InChI=1S/C16H18O4/c1-19-14-8-12(7-13(17)10-14)4-3-11-5-6-15(18)16(9-11)20-2/h5-10,17-18H,3-4H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.14E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair
Calmodulin-1 (Human)	BDBM50346816 (CHEMBL467338) Show SMILES COc1ccc(CCc2cc(OC)cc(OC)c2)cc1 Show InChI InChI=1S/C17H20O3/c1-18-15-8-6-13(7-9-15)4-5-14-10-16(19-2)12-17(11-14)20-3/h6-12H,4-5H2,1-3H3	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.46E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Inhibition of Calmodulin-dependent PDE1 activity assessed as inorganic phosphate release after 30 min				Eur J Med Chem 46: 2699-708 (2011) Article DOI: 10.1016/j.ejmech.2011.03.057 BindingDB Entry DOI: 10.7270/Q2MW2HGD
					More data for this Ligand-Target Pair