Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 290.3 BDBM68152Purchase

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
DNA damage-inducible transcript 3 protein (Mus musculus)	BDBM68152 ((2Z,6E)-4-methyl-2,6-bis(2-pyridinylmethylidene)-1...) Show SMILES CC1C\C(=C\c2ccccn2)C(=O)\C(C1)=C\c1ccccn1 Show InChI InChI=1S/C19H18N2O/c1-14-10-15(12-17-6-2-4-8-20-17)19(22)16(11-14)13-18-7-3-5-9-21-18/h2-9,12-14H,10-11H2,1H3/b15-12-,16-13+	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2PC30VZ
					More data for this Ligand-Target Pair
DNA damage-inducible transcript 3 protein (Mus musculus)	BDBM68152 ((2Z,6E)-4-methyl-2,6-bis(2-pyridinylmethylidene)-1...) Show SMILES CC1C\C(=C\c2ccccn2)C(=O)\C(C1)=C\c1ccccn1 Show InChI InChI=1S/C19H18N2O/c1-14-10-15(12-17-6-2-4-8-20-17)19(22)16(11-14)13-18-7-3-5-9-21-18/h2-9,12-14H,10-11H2,1H3/b15-12-,16-13+	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q28C9TQN
					More data for this Ligand-Target Pair
X-box-binding protein 1 (Homo sapiens (Human))	BDBM68152 ((2Z,6E)-4-methyl-2,6-bis(2-pyridinylmethylidene)-1...) Show SMILES CC1C\C(=C\c2ccccn2)C(=O)\C(C1)=C\c1ccccn1 Show InChI InChI=1S/C19H18N2O/c1-14-10-15(12-17-6-2-4-8-20-17)19(22)16(11-14)13-18-7-3-5-9-21-18/h2-9,12-14H,10-11H2,1H3/b15-12-,16-13+	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2NK3CGB
					More data for this Ligand-Target Pair