null

SMILES: COC[C@H]1C[C@@]2(C1)CN(C)C(=O)c1c(OC(=O)\C=C\C(O)=O)c(=O)c(cn21)C(=O)NCc1cccc(Cl)c1F

InChI Key: InChIKey=GTQKSWMAJVOYPO-PJCPLUNWSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 288121   

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
Protein Nef (Human immunodeficiency virus type 1 (isolate BRU/L...)	BDBM288121 (Production of (E)-4-[7′-(3-chloro-2-fluorobe...) Show SMILES COC[C@H]1C[C@@]2(C1)CN(C)C(=O)c1c(OC(=O)\C=C\C(O)=O)c(=O)c(cn21)C(=O)NCc1cccc(Cl)c1F |r,wU:5.5,wD:3.2,(10.06,-11.91,;8.72,-12.68,;7.39,-11.91,;7.39,-10.37,;8.48,-9.28,;7.39,-8.19,;6.3,-9.28,;8.72,-7.42,;8.72,-5.88,;10.06,-5.11,;7.39,-5.11,;7.39,-3.57,;6.05,-5.88,;4.72,-5.11,;4.72,-3.57,;3.39,-2.8,;3.39,-1.26,;2.05,-3.57,;.72,-2.8,;-.61,-3.57,;-1.95,-2.8,;-.61,-5.11,;3.39,-5.88,;2.05,-5.11,;3.39,-7.42,;4.72,-8.19,;6.05,-7.42,;2.05,-8.19,;2.05,-9.73,;.72,-7.42,;-.61,-8.19,;-1.95,-7.42,;-1.95,-5.88,;-3.28,-5.11,;-4.61,-5.88,;-4.61,-7.42,;-5.95,-8.19,;-3.28,-8.19,;-3.28,-9.73,)| Show InChI InChI=1S/C26H25ClFN3O8/c1-30-13-26(8-14(9-26)12-38-2)31-11-16(24(36)29-10-15-4-3-5-17(27)20(15)28)22(35)23(21(31)25(30)37)39-19(34)7-6-18(32)33/h3-7,11,14H,8-10,12-13H2,1-2H3,(H,29,36)(H,32,33)/b7-6+/t14-,26+	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.40	n/a	n/a	n/a	25
JAPAN TOBACCO INC. US Patent					Assay Description The medium (40 μL), a test substance (10 μL) diluted with the medium, and a 1×105 cells/mL MT-4 cell suspension (50 μL) wherein HIV-1 ...				US Patent US10087178 (2018) BindingDB Entry DOI: 10.7270/Q20C4XSD
					More data for this Ligand-Target Pair