Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 277.3 BDBM50553870

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))	BDBM50553870 (CHEMBL4749823) Show SMILES Cc1ccc2c(n[nH]c2c1)-c1cccc(NC(=O)C=C)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of MAP2K7 (unknown origin) using JNK peptide KFMMTPYVVTR incubated for 30 mins measured by multimode reader based ADP-glo assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127546 BindingDB Entry DOI: 10.7270/Q2QN6BDG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Dual specificity mitogen-activated protein kinase kinase 7 (Homo sapiens (Human))	BDBM50553870 (CHEMBL4749823) Show SMILES Cc1ccc2c(n[nH]c2c1)-c1cccc(NC(=O)C=C)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of MEK7 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127203 BindingDB Entry DOI: 10.7270/Q2028W77
					More data for this Ligand-Target Pair				3D Structure (crystal)