Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Telomerase reverse transcriptase' and Ligand = 'BDBM50080844'   

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
Telomerase reverse transcriptase (Homo sapiens (Human))	BDBM50080844 (3-Diethylamino-N-[6-(3-diethylamino-propionylamino...) Show SMILES CCN(CC)CCC(=O)Nc1ccc2cc3ccc(NC(=O)CCN(CC)CC)cc3nc2c1 Show InChI InChI=1S/C27H37N5O2/c1-5-31(6-2)15-13-26(33)28-22-11-9-20-17-21-10-12-23(19-25(21)30-24(20)18-22)29-27(34)14-16-32(7-3)8-4/h9-12,17-19H,5-8,13-16H2,1-4H3,(H,28,33)(H,29,34)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Central University of Las Villas Curated by ChEMBL					Assay Description Inhibition of telomerase in human A2780 cells by TRAP assay				Eur J Med Chem 44: 4826-40 (2009) Article DOI: 10.1016/j.ejmech.2009.07.029 BindingDB Entry DOI: 10.7270/Q20R9PHM
					More data for this Ligand-Target Pair
Telomerase reverse transcriptase (Homo sapiens (Human))	BDBM50080844 (3-Diethylamino-N-[6-(3-diethylamino-propionylamino...) Show SMILES CCN(CC)CCC(=O)Nc1ccc2cc3ccc(NC(=O)CCN(CC)CC)cc3nc2c1 Show InChI InChI=1S/C27H37N5O2/c1-5-31(6-2)15-13-26(33)28-22-11-9-20-17-21-10-12-23(19-25(21)30-24(20)18-22)29-27(34)14-16-32(7-3)8-4/h9-12,17-19H,5-8,13-16H2,1-4H3,(H,28,33)(H,29,34)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Cancer Research Curated by ChEMBL					Assay Description Ability to inhibit human telomerase in a modified cell-free TRAP assay using extracts from A2780 cell line				Bioorg Med Chem Lett 9: 2463-8 (1999) BindingDB Entry DOI: 10.7270/Q2H41QN7
					More data for this Ligand-Target Pair