Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 393.4 BDBM50051806

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

Found 2 hits 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
M-phase inducer phosphatase 1 (Homo sapiens (Human))	BDBM50051806 ((N-methylmorpholino)ethanol dodecyl phosphonate | ...) Show SMILES CCCCCCCCCCCCOP([O-])(=O)OCC[N+]1(C)CCOCC1 Show InChI InChI=1S/C19H40NO5P/c1-3-4-5-6-7-8-9-10-11-12-16-24-26(21,22)25-19-15-20(2)13-17-23-18-14-20/h3-19H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Hellenic Research Foundation Curated by ChEMBL					Assay Description Inhibition of Cell division cycle 25 (Cdc25) phosphatase				J Med Chem 39: 2609-14 (1996) Article DOI: 10.1021/jm9509152 BindingDB Entry DOI: 10.7270/Q2G15ZXW
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50051806 ((N-methylmorpholino)ethanol dodecyl phosphonate | ...) Show SMILES CCCCCCCCCCCCOP([O-])(=O)OCC[N+]1(C)CCOCC1 Show InChI InChI=1S/C19H40NO5P/c1-3-4-5-6-7-8-9-10-11-12-16-24-26(21,22)25-19-15-20(2)13-17-23-18-14-20/h3-19H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
National Hellenic Research Foundation Curated by ChEMBL					Assay Description Inhibition of Cell division cycle 2 (cdc2) kinase				J Med Chem 39: 2609-14 (1996) Article DOI: 10.1021/jm9509152 BindingDB Entry DOI: 10.7270/Q2G15ZXW
					More data for this Ligand-Target Pair