Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 9' and Ligand = 'BDBM308023'   

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))	BDBM308023 ( (3R)-N-{5-chloro-4-[1-(3-fluorobenzyl)-5-methoxy-...) Show SMILES COc1cc2ncn(Cc3cccc(F)c3)c2cc1-c1cc(NC(=O)[C@@H]2CCCNC2)ncc1Cl Show InChI InChI=1S/C26H25ClFN5O2/c1-35-24-11-22-23(33(15-31-22)14-16-4-2-6-18(28)8-16)9-20(24)19-10-25(30-13-21(19)27)32-26(34)17-5-3-7-29-12-17/h2,4,6,8-11,13,15,17,29H,3,5,7,12,14H2,1H3,(H,30,32,34)/t17-/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	21	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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