Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 507.0 BDBM307993

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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))	BDBM307993 ( N-{5-chloro-4-[1-(tetrahydro-2H-pyran-4-ylmethyl)...) Show SMILES CN(C)S(=O)(=O)NCC(=O)Nc1cc(c(Cl)cn1)-c1ccc2ncn(CC3CCOCC3)c2c1 Show InChI InChI=1S/C22H27ClN6O4S/c1-28(2)34(31,32)26-12-22(30)27-21-10-17(18(23)11-24-21)16-3-4-19-20(9-16)29(14-25-19)13-15-5-7-33-8-6-15/h3-4,9-11,14-15,26H,5-8,12-13H2,1-2H3,(H,24,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	230	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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