Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 374.3 BDBM569079

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
Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S] (Homo sapiens (Human))	BDBM569079 (5-cyano-N-(3-(isoxazol-4- yl)-1H-indazol-5-yl)-4-...) Show SMILES COc1c(C)c(ncc1C#N)C(=O)Nc1ccc2[nH]nc(-c3cnoc3)c2c1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The assay was carried out under the following protocol conditions: 1 mM compound in DMSO was serially diluted 1:3, 11 points in DMSO with a Biomek FX...				Citation and Details BindingDB Entry DOI: 10.7270/Q2XG9VCH
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (Homo sapiens (Human))	BDBM569079 (5-cyano-N-(3-(isoxazol-4- yl)-1H-indazol-5-yl)-4-...) Show SMILES COc1c(C)c(ncc1C#N)C(=O)Nc1ccc2[nH]nc(-c3cnoc3)c2c1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The assay was carried out under the following protocol conditions: 1 mM compound in DMSO was serially diluted 1:3, 11 points in DMSO with a Biomek FX...				Citation and Details BindingDB Entry DOI: 10.7270/Q2XG9VCH
					More data for this Ligand-Target Pair