null

SMILES: CC(C)c1ccc(cc1)C1(CN(C1)C(=O)OC(C)(C)C)OC(=O)NC(CCO[C@H]1C[C@H](CCc2ccc3CCCNc3n2)C1)C(O)=O

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 528289   

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
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM528289 (US11180494, Example 158) Show SMILES CC(C)c1ccc(cc1)C1(CN(C1)C(=O)OC(C)(C)C)OC(=O)NC(CCO[C@H]1C[C@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r,w:24.25,wU:30.32,wD:28.29,(-11.49,-3.49,;-11.49,-1.95,;-12.82,-1.18,;-10.16,-1.18,;-10.16,.36,;-8.82,1.13,;-7.49,.36,;-7.49,-1.18,;-8.82,-1.95,;-6.4,1.45,;-4.91,1.85,;-5.31,3.34,;-6.8,2.94,;-4.54,4.67,;-5.31,6,;-3,4.67,;-2.23,6,;-.69,6,;-3,7.34,;-1.46,7.34,;-6.4,-.09,;-5.07,-.86,;-3.73,-.09,;-5.07,-2.4,;-3.73,-3.17,;-2.4,-2.4,;-1.07,-3.17,;.27,-2.4,;1.6,-3.17,;2,-4.66,;3.49,-4.26,;4.82,-5.03,;6.16,-4.26,;7.49,-5.03,;7.49,-6.57,;8.82,-7.34,;10.16,-6.57,;11.49,-7.34,;12.82,-6.57,;12.82,-5.03,;11.49,-4.26,;10.16,-5.03,;8.82,-4.26,;3.09,-2.77,;-3.73,-4.71,;-5.07,-5.48,;-2.4,-5.48,)| Show InChI	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The biochemical potency of compounds was determined using a proximity-based assay (ALPHASCREEN®, Perkin Elmer, Waltham, Mass.) as described previousl...				Citation and Details BindingDB Entry DOI: 10.7270/Q2GT5RC5
					More data for this Ligand-Target Pair