Compile Data Set for Download or QSAR

Found 5 hits of ic50 for monomerid = 50301843   

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
Cytochrome P450 2C19 (Homo sapiens (Human))	BDBM50301843 (2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)-N-(4-(m...) Show SMILES CSc1ccc(CNC(=O)CC2(C)CC3(CCCCC3)OO2)cc1 Show InChI InChI=1S/C19H27NO3S/c1-18(14-19(23-22-18)10-4-3-5-11-19)12-17(21)20-13-15-6-8-16(24-2)9-7-15/h6-9H,3-5,10-14H2,1-2H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute Infectious Diseases Initiative Curated by ChEMBL					Assay Description Inhibition of human CYP2C19				Bioorg Med Chem Lett 19: 5657-60 (2009) Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX
					More data for this Ligand-Target Pair
Cytochrome P450 2C9 (Homo sapiens (Human))	BDBM50301843 (2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)-N-(4-(m...) Show SMILES CSc1ccc(CNC(=O)CC2(C)CC3(CCCCC3)OO2)cc1 Show InChI InChI=1S/C19H27NO3S/c1-18(14-19(23-22-18)10-4-3-5-11-19)12-17(21)20-13-15-6-8-16(24-2)9-7-15/h6-9H,3-5,10-14H2,1-2H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute Infectious Diseases Initiative Curated by ChEMBL					Assay Description Inhibition of human CYP2C9				Bioorg Med Chem Lett 19: 5657-60 (2009) Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50301843 (2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)-N-(4-(m...) Show SMILES CSc1ccc(CNC(=O)CC2(C)CC3(CCCCC3)OO2)cc1 Show InChI InChI=1S/C19H27NO3S/c1-18(14-19(23-22-18)10-4-3-5-11-19)12-17(21)20-13-15-6-8-16(24-2)9-7-15/h6-9H,3-5,10-14H2,1-2H3,(H,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute Infectious Diseases Initiative Curated by ChEMBL					Assay Description Inhibition of human CYP2D6				Bioorg Med Chem Lett 19: 5657-60 (2009) Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50301843 (2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)-N-(4-(m...) Show SMILES CSc1ccc(CNC(=O)CC2(C)CC3(CCCCC3)OO2)cc1 Show InChI InChI=1S/C19H27NO3S/c1-18(14-19(23-22-18)10-4-3-5-11-19)12-17(21)20-13-15-6-8-16(24-2)9-7-15/h6-9H,3-5,10-14H2,1-2H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute Infectious Diseases Initiative Curated by ChEMBL					Assay Description Inhibition of human CYP3A4				Bioorg Med Chem Lett 19: 5657-60 (2009) Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX
					More data for this Ligand-Target Pair
Cytochrome P450 1A2 (Homo sapiens (Human))	BDBM50301843 (2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)-N-(4-(m...) Show SMILES CSc1ccc(CNC(=O)CC2(C)CC3(CCCCC3)OO2)cc1 Show InChI InChI=1S/C19H27NO3S/c1-18(14-19(23-22-18)10-4-3-5-11-19)12-17(21)20-13-15-6-8-16(24-2)9-7-15/h6-9H,3-5,10-14H2,1-2H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute Infectious Diseases Initiative Curated by ChEMBL					Assay Description Inhibition of human CYP1A2				Bioorg Med Chem Lett 19: 5657-60 (2009) Article DOI: 10.1016/j.bmcl.2009.08.024 BindingDB Entry DOI: 10.7270/Q22R3RRX
					More data for this Ligand-Target Pair