Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 513.9 BDBM50594444

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
Dual specificity mitogen-activated protein kinase kinase 7 (Homo sapiens (Human))	BDBM50594444 (CHEMBL5174214) Show SMILES Nc1ncnc2n(nc(-c3cn(CC(F)(F)c4ccc(Cl)cc4)nn3)c12)[C@@H]1CCCN(C1)C(=O)C=C |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02206 BindingDB Entry DOI: 10.7270/Q2765KB8
					More data for this Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 7 (Homo sapiens (Human))	BDBM50594444 (CHEMBL5174214) Show SMILES Nc1ncnc2n(nc(-c3cn(CC(F)(F)c4ccc(Cl)cc4)nn3)c12)[C@@H]1CCCN(C1)C(=O)C=C |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	380	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02206 BindingDB Entry DOI: 10.7270/Q2765KB8
					More data for this Ligand-Target Pair