BDBM50333253 CHEMBL1645246::N1-(4-chloro-3-fluorophenyl)-N2-((4-(dimethylamino)-1-methylpiperidin-4-yl)methyl)oxalamide

SMILES: CN(C)C1(CNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)CCN(C)CC1

InChI Key: InChIKey=FOCAFJYJZZZDQT-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50333253   

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
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333253 (CHEMBL1645246 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES CN(C)C1(CNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)CCN(C)CC1 Show InChI InChI=1S/C17H24ClFN4O2/c1-22(2)17(6-8-23(3)9-7-17)11-20-15(24)16(25)21-12-4-5-13(18)14(19)10-12/h4-5,10H,6-9,11H2,1-3H3,(H,20,24)(H,21,25)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Inhibition of HIV1 YU2 gp120 binding to CD4 expressing Cf2Th-CD4/CCR5 cells assessed as inhibition of viral infection after 48 hrs				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair