null

SMILES: Cc1noc(C)c1-c1cc(F)c2nc(N3CCC(O)C3)n3C(COc1c23)c1cccnc1

InChI Key: InChIKey=QYRYLHRDXIRGBH-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 318616   

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
Bromodomain-containing protein 4 [49-170] (Homo sapiens (Human))	BDBM318616 (1-[7-(3,5-Dimethylisoxazol-4-yl)-9-fluoro-4-pyridi...) Show SMILES Cc1noc(C)c1-c1cc(F)c2nc(N3CCC(O)C3)n3C(COc1c23)c1cccnc1 |(-1.8,-6.16,;-3.14,-5.39,;-4.6,-5.87,;-5.51,-4.62,;-4.6,-3.37,;-5.37,-2.04,;-3.14,-3.85,;-1.8,-3.08,;-.47,-3.85,;.86,-3.08,;2.2,-3.85,;.86,-1.54,;2.2,-.77,;1.39,.87,;2.16,2.21,;1.68,3.67,;2.93,4.58,;4.17,3.67,;5.51,4.44,;3.7,2.21,;-.47,.77,;-1.8,1.54,;-3.14,.77,;-3.14,-.77,;-1.8,-1.54,;-.47,-.77,;-1.8,3.08,;-3.14,3.85,;-3.14,5.39,;-1.8,6.16,;-.47,5.39,;-.47,3.85,)| Show InChI InChI=1S/C23H22FN5O3/c1-12-19(13(2)32-27-12)16-8-17(24)20-21-22(16)31-11-18(14-4-3-6-25-9-14)29(21)23(26-20)28-7-5-15(30)10-28/h3-4,6,8-9,15,18,30H,5,7,10-11H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Corporation; Incyte Holdings Corporation US Patent					Assay Description BRD4-BD1 and BRD4-BD2 assays were conducted in white 384-well polystyrene plate in a final volume of 20 μL for BD1 and 40 μL for BD2. Inhib...				US Patent US9624241 (2017) BindingDB Entry DOI: 10.7270/Q2NZ89QB
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [342-460] (Homo sapiens (Human))	BDBM318616 (1-[7-(3,5-Dimethylisoxazol-4-yl)-9-fluoro-4-pyridi...) Show SMILES Cc1noc(C)c1-c1cc(F)c2nc(N3CCC(O)C3)n3C(COc1c23)c1cccnc1 |(-1.8,-6.16,;-3.14,-5.39,;-4.6,-5.87,;-5.51,-4.62,;-4.6,-3.37,;-5.37,-2.04,;-3.14,-3.85,;-1.8,-3.08,;-.47,-3.85,;.86,-3.08,;2.2,-3.85,;.86,-1.54,;2.2,-.77,;1.39,.87,;2.16,2.21,;1.68,3.67,;2.93,4.58,;4.17,3.67,;5.51,4.44,;3.7,2.21,;-.47,.77,;-1.8,1.54,;-3.14,.77,;-3.14,-.77,;-1.8,-1.54,;-.47,-.77,;-1.8,3.08,;-3.14,3.85,;-3.14,5.39,;-1.8,6.16,;-.47,5.39,;-.47,3.85,)| Show InChI InChI=1S/C23H22FN5O3/c1-12-19(13(2)32-27-12)16-8-17(24)20-21-22(16)31-11-18(14-4-3-6-25-9-14)29(21)23(26-20)28-7-5-15(30)10-28/h3-4,6,8-9,15,18,30H,5,7,10-11H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Holdings Corporation; Incyte Corporation US Patent					Assay Description BRD4-BD1 and BRD4-BD2 assays were conducted in white 384-well polystyrene plate in a final volume of 40 μL for BD1 and 60 μL for BD2. Inhib...				US Patent US10464947 (2019) BindingDB Entry DOI: 10.7270/Q2TT4TB8
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [42-168] (Homo sapiens (Human))	BDBM318616 (1-[7-(3,5-Dimethylisoxazol-4-yl)-9-fluoro-4-pyridi...) Show SMILES Cc1noc(C)c1-c1cc(F)c2nc(N3CCC(O)C3)n3C(COc1c23)c1cccnc1 |(-1.8,-6.16,;-3.14,-5.39,;-4.6,-5.87,;-5.51,-4.62,;-4.6,-3.37,;-5.37,-2.04,;-3.14,-3.85,;-1.8,-3.08,;-.47,-3.85,;.86,-3.08,;2.2,-3.85,;.86,-1.54,;2.2,-.77,;1.39,.87,;2.16,2.21,;1.68,3.67,;2.93,4.58,;4.17,3.67,;5.51,4.44,;3.7,2.21,;-.47,.77,;-1.8,1.54,;-3.14,.77,;-3.14,-.77,;-1.8,-1.54,;-.47,-.77,;-1.8,3.08,;-3.14,3.85,;-3.14,5.39,;-1.8,6.16,;-.47,5.39,;-.47,3.85,)| Show InChI InChI=1S/C23H22FN5O3/c1-12-19(13(2)32-27-12)16-8-17(24)20-21-22(16)31-11-18(14-4-3-6-25-9-14)29(21)23(26-20)28-7-5-15(30)10-28/h3-4,6,8-9,15,18,30H,5,7,10-11H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Holdings Corporation; Incyte Corporation US Patent					Assay Description BRD4-BD1 and BRD4-BD2 assays were conducted in white 384-well polystyrene plate in a final volume of 40 μL for BD1 and 60 μL for BD2. Inhib...				US Patent US10464947 (2019) BindingDB Entry DOI: 10.7270/Q2TT4TB8
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [342-460] (Homo sapiens (Human))	BDBM318616 (1-[7-(3,5-Dimethylisoxazol-4-yl)-9-fluoro-4-pyridi...) Show SMILES Cc1noc(C)c1-c1cc(F)c2nc(N3CCC(O)C3)n3C(COc1c23)c1cccnc1 |(-1.8,-6.16,;-3.14,-5.39,;-4.6,-5.87,;-5.51,-4.62,;-4.6,-3.37,;-5.37,-2.04,;-3.14,-3.85,;-1.8,-3.08,;-.47,-3.85,;.86,-3.08,;2.2,-3.85,;.86,-1.54,;2.2,-.77,;1.39,.87,;2.16,2.21,;1.68,3.67,;2.93,4.58,;4.17,3.67,;5.51,4.44,;3.7,2.21,;-.47,.77,;-1.8,1.54,;-3.14,.77,;-3.14,-.77,;-1.8,-1.54,;-.47,-.77,;-1.8,3.08,;-3.14,3.85,;-3.14,5.39,;-1.8,6.16,;-.47,5.39,;-.47,3.85,)| Show InChI InChI=1S/C23H22FN5O3/c1-12-19(13(2)32-27-12)16-8-17(24)20-21-22(16)31-11-18(14-4-3-6-25-9-14)29(21)23(26-20)28-7-5-15(30)10-28/h3-4,6,8-9,15,18,30H,5,7,10-11H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Corporation; Incyte Holdings Corporation US Patent					Assay Description BRD4-BD1 and BRD4-BD2 assays were conducted in white 384-well polystyrene plate in a final volume of 20 μL for BD1 and 40 μL for BD2. Inhib...				US Patent US9624241 (2017) BindingDB Entry DOI: 10.7270/Q2NZ89QB
					More data for this Ligand-Target Pair