Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Cytochrome P450 2D6' and Ligand = 'BDBM50325614'   

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 2D6 (Homo sapiens (Human))	BDBM50325614 ((3-benzyl pyrrolidin-3-yl)(7-fluoro-1H-indol-5-yl)...) Show SMILES Fc1cc(cc2cc[nH]c12)C(=O)C1(Cc2ccccc2)CCNC1 Show InChI InChI=1S/C20H19FN2O/c21-17-11-16(10-15-6-8-23-18(15)17)19(24)20(7-9-22-13-20)12-14-4-2-1-3-5-14/h1-6,8,10-11,22-23H,7,9,12-13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Roche Palo Alto LLC Curated by ChEMBL					Assay Description Inhibition of CYP2D6				Bioorg Med Chem Lett 20: 5559-66 (2010) Article DOI: 10.1016/j.bmcl.2010.07.020 BindingDB Entry DOI: 10.7270/Q20865HF
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50325614 ((3-benzyl pyrrolidin-3-yl)(7-fluoro-1H-indol-5-yl)...) Show SMILES Fc1cc(cc2cc[nH]c12)C(=O)C1(Cc2ccccc2)CCNC1 Show InChI InChI=1S/C20H19FN2O/c21-17-11-16(10-15-6-8-23-18(15)17)19(24)20(7-9-22-13-20)12-14-4-2-1-3-5-14/h1-6,8,10-11,22-23H,7,9,12-13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Roche Palo Alto LLC Curated by ChEMBL					Assay Description Inhibition of CYP2D6				Bioorg Med Chem Lett 20: 5559-66 (2010) Article DOI: 10.1016/j.bmcl.2010.07.020 BindingDB Entry DOI: 10.7270/Q20865HF
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50325614 ((3-benzyl pyrrolidin-3-yl)(7-fluoro-1H-indol-5-yl)...) Show SMILES Fc1cc(cc2cc[nH]c12)C(=O)C1(Cc2ccccc2)CCNC1 Show InChI InChI=1S/C20H19FN2O/c21-17-11-16(10-15-6-8-23-18(15)17)19(24)20(7-9-22-13-20)12-14-4-2-1-3-5-14/h1-6,8,10-11,22-23H,7,9,12-13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Roche Palo Alto LLC Curated by ChEMBL					Assay Description Inhibition of CYP2D6				Bioorg Med Chem Lett 20: 5559-66 (2010) Article DOI: 10.1016/j.bmcl.2010.07.020 BindingDB Entry DOI: 10.7270/Q20865HF
					More data for this Ligand-Target Pair