Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 9' and Ligand = 'BDBM307846'   

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))	BDBM307846 ((3R)-N-{5-chloro-4-[1-(3-fluorobenzyl)-2-methyl-1H...) Show SMILES Cc1nc2ccc(cc2n1Cc1cccc(F)c1)-c1cc(NC(=O)[C@@H]2CCCNC2)ncc1Cl Show InChI InChI=1S/C26H25ClFN5O/c1-16-31-23-8-7-18(11-24(23)33(16)15-17-4-2-6-20(28)10-17)21-12-25(30-14-22(21)27)32-26(34)19-5-3-9-29-13-19/h2,4,6-8,10-12,14,19,29H,3,5,9,13,15H2,1H3,(H,30,32,34)/t19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
AbbVie Inc. US Patent					Assay Description CDK9 enzyme activities were measured using LANCE ULight TR-FRET kinase assay reagents (PerkinElmer, Waltham, Mass.). Compounds were directly added in...				US Patent US9650358 (2017) BindingDB Entry DOI: 10.7270/Q2057J0M
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