Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Bromodomain-containing protein 4 [49-170]' and Ligand = 'BDBM480644'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Bromodomain-containing protein 4 [49-170] (Homo sapiens (Human))	BDBM480644 (US10899769, Example 33b) Show SMILES C[C@H]1C(=O)N(C)Cc2c(nc(C3CCOCC3)n12)-c1c(F)ccc2cc(ncc12)-n1cnc(C)c1 |r,wD:1.0,(8.86,-2.42,;8.86,-.88,;10.2,-.11,;11.53,-.88,;10.2,1.43,;11.53,2.2,;8.86,2.2,;7.53,1.43,;6.06,1.9,;5.16,.66,;6.06,-.59,;5.59,-2.06,;6.62,-3.2,;6.14,-4.66,;4.64,-4.98,;3.61,-3.84,;4.08,-2.38,;7.53,-.11,;5.59,3.37,;4.08,3.69,;3.05,2.54,;3.61,5.15,;4.64,6.29,;6.14,5.97,;7.17,7.12,;8.68,6.8,;9.16,5.33,;8.13,4.19,;6.62,4.51,;9.71,7.94,;9.39,9.45,;10.72,10.22,;11.87,9.19,;13.37,9.51,;11.24,7.78,)| Show InChI InChI=1S/C26H27FN6O2/c1-15-12-32(14-29-15)22-10-18-4-5-20(27)23(19(18)11-28-22)24-21-13-31(3)26(34)16(2)33(21)25(30-24)17-6-8-35-9-7-17/h4-5,10-12,14,16-17H,6-9,13H2,1-3H3/t16-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Board of Regents, The University of Texas System US Patent					Assay Description BRD4: 2.5 nM of BRD4(49-170) and 10 nM biotin-H4(1-21) Ac-K5/8/12/16 (AnaSpec. 64989) were incubated with varying concentrations of CBP inhibitors in...				US Patent US10899769 (2021) BindingDB Entry DOI: 10.7270/Q2H41VJJ
					More data for this Ligand-Target Pair