Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 435.9 BDBM307804

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))	BDBM307804 ( N-[2-(azetidin-2-yl)ethyl]-5-chloro-4-[1-(3-fluor...) Show SMILES Fc1cccc(Cn2cnc3ccc(cc23)-c2cc(NCCC3CCN3)ncc2Cl)c1 Show InChI InChI=1S/C24H23ClFN5/c25-21-13-29-24(28-9-7-19-6-8-27-19)12-20(21)17-4-5-22-23(11-17)31(15-30-22)14-16-2-1-3-18(26)10-16/h1-5,10-13,15,19,27H,6-9,14H2,(H,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	240	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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