BDBM50023421 CHEMBL3334637

SMILES: Cc1ccc(CNC(=O)c2nc([nH]c(=O)c2O)-c2ccc(F)cc2)cc1C

InChI Key: InChIKey=KNVLMNKVHMDRKF-UHFFFAOYSA-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 = 50023421   

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
Integrase (Human immunodeficiency virus 1)	BDBM50023421 (CHEMBL3334637) Show SMILES Cc1ccc(CNC(=O)c2nc([nH]c(=O)c2O)-c2ccc(F)cc2)cc1C Show InChI InChI=1S/C20H18FN3O3/c1-11-3-4-13(9-12(11)2)10-22-19(26)16-17(25)20(27)24-18(23-16)14-5-7-15(21)8-6-14/h3-9,25H,10H2,1-2H3,(H,22,26)(H,23,24,27)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant wild type integrase 3'-processing activity by gel-based assays				Bioorg Med Chem 22: 5446-53 (2014) Article DOI: 10.1016/j.bmc.2014.07.036 BindingDB Entry DOI: 10.7270/Q2WM1G02
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50023421 (CHEMBL3334637) Show SMILES Cc1ccc(CNC(=O)c2nc([nH]c(=O)c2O)-c2ccc(F)cc2)cc1C Show InChI InChI=1S/C20H18FN3O3/c1-11-3-4-13(9-12(11)2)10-22-19(26)16-17(25)20(27)24-18(23-16)14-5-7-15(21)8-6-14/h3-9,25H,10H2,1-2H3,(H,22,26)(H,23,24,27)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant wild type integrase strand transfer activity by gel-based assay				Bioorg Med Chem 22: 5446-53 (2014) Article DOI: 10.1016/j.bmc.2014.07.036 BindingDB Entry DOI: 10.7270/Q2WM1G02
					More data for this Ligand-Target Pair