BDBM50333270 4-(3-((4-(4,4-dimethylpent-1-en-2-yl)cyclohexyl)methyl)-2-methylenebut-3-enyl)-1,2-dimethylbenzene::CHEMBL1645122

SMILES: CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1

InChI Key: InChIKey=PPDMVLKBLMCDCE-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 = 50333270   

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...)	BDBM50333270 (4-(3-((4-(4,4-dimethylpent-1-en-2-yl)cyclohexyl)me...) Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C18H23ClFN3O4/c1-18(2,3)27-17(26)23-8-6-11(7-9-23)21-15(24)16(25)22-12-4-5-13(19)14(20)10-12/h4-5,10-11H,6-9H2,1-3H3,(H,21,24)(H,22,25)	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar	CHEMBL 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
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