Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 9' and Ligand = 'BDBM50532766'   

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
Cyclin-dependent kinase 9 (Homo sapiens (Human))	BDBM50532766 (CHEMBL4448572) Show SMILES COCCNC(=O)Nc1nc2cc(OS(=O)(=O)c3c(F)cccc3F)ccc2[nH]1 Show InChI InChI=1S/C17H16F2N4O5S/c1-27-8-7-20-17(24)23-16-21-13-6-5-10(9-14(13)22-16)28-29(25,26)15-11(18)3-2-4-12(15)19/h2-6,9H,7-8H2,1H3,(H3,20,21,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of CDK9 (unknown origin)				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 9 (Homo sapiens (Human))	BDBM50532766 (CHEMBL4448572) Show SMILES COCCNC(=O)Nc1nc2cc(OS(=O)(=O)c3c(F)cccc3F)ccc2[nH]1 Show InChI InChI=1S/C17H16F2N4O5S/c1-27-8-7-20-17(24)23-16-21-13-6-5-10(9-14(13)22-16)28-29(25,26)15-11(18)3-2-4-12(15)19/h2-6,9H,7-8H2,1H3,(H3,20,21,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of CDK9 (unknown origin)				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair