Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 443.5 BDBM613815

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

Found 3 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
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM613815 (5-(1-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-y...) Show SMILES Cc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCCC1)-c1ccc(F)cc1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	152	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent									US Patent US11001589 (2021) BindingDB Entry DOI: 10.7270/Q2N30228
					More data for this Ligand-Target Pair
TRAF2 and NCK-interacting protein kinase (Homo sapiens (Human))	BDBM613815 (5-(1-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-y...) Show SMILES Cc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCCC1)-c1ccc(F)cc1 Show InChI	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	152	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent									US Patent US11001589 (2021) BindingDB Entry DOI: 10.7270/Q2N30228
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase kinase 4 (Homo sapiens (Human))	BDBM613815 (5-(1-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-y...) Show SMILES Cc1ccccc1NC(=O)c1ccc(o1)-c1c(ncn1C1CCCCC1)-c1ccc(F)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
ASTRAZENECA AB US Patent									US Patent US11001589 (2021) BindingDB Entry DOI: 10.7270/Q2N30228
					More data for this Ligand-Target Pair