BDBM50481425 CHEMBL597777::ZINC 01078734

SMILES: OC(=O)COc1ccccc1\C=N/NC(=O)Cc1csc(Nc2cccc(c2)C(F)(F)F)n1

InChI Key: InChIKey=TZYCJQGYAOUYGY-MRUKODCESA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50481425   

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
Genome polyprotein (Dengue virus type 2)	BDBM50481425 (CHEMBL597777 | ZINC 01078734) Show SMILES OC(=O)COc1ccccc1\C=N/NC(=O)Cc1csc(Nc2cccc(c2)C(F)(F)F)n1 Show InChI InChI=1S/C21H17F3N4O4S/c22-21(23,24)14-5-3-6-15(8-14)26-20-27-16(12-33-20)9-18(29)28-25-10-13-4-1-2-7-17(13)32-11-19(30)31/h1-8,10,12H,9,11H2,(H,26,27)(H,28,29)(H,30,31)/b25-10-	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Basel Curated by ChEMBL					Assay Description Inhibition of Dengue virus type 2 NS5 RNA methyltransferase RNA site				J Med Chem 53: 1483-95 (2010) Article DOI: 10.1021/jm900776m BindingDB Entry DOI: 10.7270/Q2ST7SNQ
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus type 2)	BDBM50481425 (CHEMBL597777 | ZINC 01078734) Show SMILES OC(=O)COc1ccccc1\C=N/NC(=O)Cc1csc(Nc2cccc(c2)C(F)(F)F)n1 Show InChI InChI=1S/C21H17F3N4O4S/c22-21(23,24)14-5-3-6-15(8-14)26-20-27-16(12-33-20)9-18(29)28-25-10-13-4-1-2-7-17(13)32-11-19(30)31/h1-8,10,12H,9,11H2,(H,26,27)(H,28,29)(H,30,31)/b25-10-	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Basel Curated by ChEMBL					Assay Description Inhibition of Dengue virus type 2 NS5 RNA methyltransferase RNA site with 0.1 % TX100				J Med Chem 53: 1483-95 (2010) Article DOI: 10.1021/jm900776m BindingDB Entry DOI: 10.7270/Q2ST7SNQ
					More data for this Ligand-Target Pair