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null

SMILES: Cc1[nH]c2c(NCc3c(C)cccc3C)nc(cc2c1C)N1CCCC1=O

InChI Key: InChIKey=SZPJAZAOTADHKI-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50311759
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50311759 (1-(7-(2,6-dimethylbenzylamino)-2,3-dimethyl-1H-pyr...) Show SMILES Show InChI	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	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of CYP3A4 using 7-benzyloxyquinoline substrate				Bioorg Med Chem Lett 19: 6813-7 (2009) Article DOI: 10.1016/j.bmcl.2009.07.002 BindingDB Entry DOI: 10.7270/Q2MC9046
GlaxoSmithKline R&D Curated by ChEMBL					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50311759 (1-(7-(2,6-dimethylbenzylamino)-2,3-dimethyl-1H-pyr...) Show SMILES Show InChI	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	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of CYP3A4 using diethoxyfluorescein substrate				Bioorg Med Chem Lett 19: 6813-7 (2009) Article DOI: 10.1016/j.bmcl.2009.07.002 BindingDB Entry DOI: 10.7270/Q2MC9046
GlaxoSmithKline R&D Curated by ChEMBL					More data for this Ligand-Target Pair
Cytochrome P450 1A2 (Homo sapiens (Human))	BDBM50311759 (1-(7-(2,6-dimethylbenzylamino)-2,3-dimethyl-1H-pyr...) Show SMILES Show InChI	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	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of CYP1A2				Bioorg Med Chem Lett 19: 6813-7 (2009) Article DOI: 10.1016/j.bmcl.2009.07.002 BindingDB Entry DOI: 10.7270/Q2MC9046
GlaxoSmithKline R&D Curated by ChEMBL					More data for this Ligand-Target Pair
Cytochrome P450 2C19 (Homo sapiens (Human))	BDBM50311759 (1-(7-(2,6-dimethylbenzylamino)-2,3-dimethyl-1H-pyr...) Show SMILES Show InChI	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	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of CYP2C19				Bioorg Med Chem Lett 19: 6813-7 (2009) Article DOI: 10.1016/j.bmcl.2009.07.002 BindingDB Entry DOI: 10.7270/Q2MC9046
GlaxoSmithKline R&D Curated by ChEMBL					More data for this Ligand-Target Pair
Cytochrome P450 2C9 (Homo sapiens (Human))	BDBM50311759 (1-(7-(2,6-dimethylbenzylamino)-2,3-dimethyl-1H-pyr...) Show SMILES Show InChI	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	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of CYP2C9				Bioorg Med Chem Lett 19: 6813-7 (2009) Article DOI: 10.1016/j.bmcl.2009.07.002 BindingDB Entry DOI: 10.7270/Q2MC9046
GlaxoSmithKline R&D Curated by ChEMBL					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50311759 (1-(7-(2,6-dimethylbenzylamino)-2,3-dimethyl-1H-pyr...) Show SMILES Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of CYP2D6				Bioorg Med Chem Lett 19: 6813-7 (2009) Article DOI: 10.1016/j.bmcl.2009.07.002 BindingDB Entry DOI: 10.7270/Q2MC9046
GlaxoSmithKline R&D Curated by ChEMBL					More data for this Ligand-Target Pair