null

SMILES: CN1CCN(CC1)c1ccc(Nc2nccc(n2)-c2sc(N)nc2-c2ccc(F)cc2)cc1

InChI Key: InChIKey=IUBBVBGLQMKSFO-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50530647   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
cGMP-dependent protein kinase (Plasmodium falciparum)	BDBM50530647 (CHEMBL4585607) Show SMILES CN1CCN(CC1)c1ccc(Nc2nccc(n2)-c2sc(N)nc2-c2ccc(F)cc2)cc1 Show InChI InChI=1S/C24H24FN7S/c1-31-12-14-32(15-13-31)19-8-6-18(7-9-19)28-24-27-11-10-20(29-24)22-21(30-23(26)33-22)16-2-4-17(25)5-3-16/h2-11H,12-15H2,1H3,(H2,26,30)(H,27,28,29)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.30	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum full length N-terminal His-tagged PKG expressed in Escherichia coli RosettaTM 2(DE3) pLysS cells using FAM-GRTGRR...				J Med Chem 62: 9217-9235 (2019) Article DOI: 10.1021/acs.jmedchem.9b01099
					More data for this Ligand-Target Pair
cGMP-dependent protein kinase (Plasmodium falciparum)	BDBM50530647 (CHEMBL4585607) Show SMILES CN1CCN(CC1)c1ccc(Nc2nccc(n2)-c2sc(N)nc2-c2ccc(F)cc2)cc1 Show InChI InChI=1S/C24H24FN7S/c1-31-12-14-32(15-13-31)19-8-6-18(7-9-19)28-24-27-11-10-20(29-24)22-21(30-23(26)33-22)16-2-4-17(25)5-3-16/h2-11H,12-15H2,1H3,(H2,26,30)(H,27,28,29)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.30	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum full length N-terminal His-tagged PKG expressed in Escherichia coli RosettaTM 2(DE3) pLysS cells using FAM-GRTGRR...				J Med Chem 62: 9217-9235 (2019) Article DOI: 10.1021/acs.jmedchem.9b01099
					More data for this Ligand-Target Pair