Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 482.9 BDBM307818

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))	BDBM307818 ( (3R)-N-{5-chloro-4-[1-(3,4-difluorobenzyl)-1H-ben...) Show SMILES Fc1ccc(Cn2nnc3ccc(cc23)-c2cc(NC(=O)[C@@H]3CCCNC3)ncc2Cl)cc1F Show InChI InChI=1S/C24H21ClF2N6O/c25-18-12-29-23(30-24(34)16-2-1-7-28-11-16)10-17(18)15-4-6-21-22(9-15)33(32-31-21)13-14-3-5-19(26)20(27)8-14/h3-6,8-10,12,16,28H,1-2,7,11,13H2,(H,29,30,34)/t16-/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	19	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
					More data for this Ligand-Target Pair