null

SMILES: Cc1noc(C)c1-c1ccc2nc(N3CCNCC3)n3[C@H](COc1c23)c1ccccn1

InChI Key: InChIKey=OFPKYPUUGHSBCE-LJQANCHMSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 318609   

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))	BDBM318609 ((4S)-7-(3,5-Dimethylisoxazol-4-yl)-2-piperazin-1-y...) Show SMILES Cc1noc(C)c1-c1ccc2nc(N3CCNCC3)n3[C@H](COc1c23)c1ccccn1 |r,wD:20.29,(-1.03,-6.16,;-2.36,-5.39,;-3.83,-5.87,;-4.73,-4.62,;-3.83,-3.37,;-4.6,-2.04,;-2.36,-3.85,;-1.03,-3.08,;.3,-3.85,;1.64,-3.08,;1.64,-1.54,;2.41,-.21,;1.64,1.13,;2.41,2.46,;3.96,2.46,;4.73,3.79,;3.96,5.13,;2.42,5.13,;1.65,3.79,;.3,.77,;-1.03,1.54,;-2.36,.77,;-2.36,-.77,;-1.03,-1.54,;.3,-.77,;-1.03,3.08,;-2.36,3.85,;-2.36,5.39,;-1.03,6.16,;.3,5.39,;.3,3.85,)| Show InChI InChI=1S/C23H24N6O2/c1-14-20(15(2)31-27-14)16-6-7-18-21-22(16)30-13-19(17-5-3-4-8-25-17)29(21)23(26-18)28-11-9-24-10-12-28/h3-8,19,24H,9-13H2,1-2H3/t19-/m1/s1	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))	BDBM318609 ((4S)-7-(3,5-Dimethylisoxazol-4-yl)-2-piperazin-1-y...) Show SMILES Cc1noc(C)c1-c1ccc2nc(N3CCNCC3)n3[C@H](COc1c23)c1ccccn1 |r,wD:20.29,(-1.03,-6.16,;-2.36,-5.39,;-3.83,-5.87,;-4.73,-4.62,;-3.83,-3.37,;-4.6,-2.04,;-2.36,-3.85,;-1.03,-3.08,;.3,-3.85,;1.64,-3.08,;1.64,-1.54,;2.41,-.21,;1.64,1.13,;2.41,2.46,;3.96,2.46,;4.73,3.79,;3.96,5.13,;2.42,5.13,;1.65,3.79,;.3,.77,;-1.03,1.54,;-2.36,.77,;-2.36,-.77,;-1.03,-1.54,;.3,-.77,;-1.03,3.08,;-2.36,3.85,;-2.36,5.39,;-1.03,6.16,;.3,5.39,;.3,3.85,)| Show InChI InChI=1S/C23H24N6O2/c1-14-20(15(2)31-27-14)16-6-7-18-21-22(16)30-13-19(17-5-3-4-8-25-17)29(21)23(26-18)28-11-9-24-10-12-28/h3-8,19,24H,9-13H2,1-2H3/t19-/m1/s1	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 [353-454] (Homo sapiens (Human))	BDBM318609 ((4S)-7-(3,5-Dimethylisoxazol-4-yl)-2-piperazin-1-y...) Show SMILES Cc1noc(C)c1-c1ccc2nc(N3CCNCC3)n3[C@H](COc1c23)c1ccccn1 |r,wD:20.29,(-1.03,-6.16,;-2.36,-5.39,;-3.83,-5.87,;-4.73,-4.62,;-3.83,-3.37,;-4.6,-2.04,;-2.36,-3.85,;-1.03,-3.08,;.3,-3.85,;1.64,-3.08,;1.64,-1.54,;2.41,-.21,;1.64,1.13,;2.41,2.46,;3.96,2.46,;4.73,3.79,;3.96,5.13,;2.42,5.13,;1.65,3.79,;.3,.77,;-1.03,1.54,;-2.36,.77,;-2.36,-.77,;-1.03,-1.54,;.3,-.77,;-1.03,3.08,;-2.36,3.85,;-2.36,5.39,;-1.03,6.16,;.3,5.39,;.3,3.85,)| Show InChI InChI=1S/C23H24N6O2/c1-14-20(15(2)31-27-14)16-6-7-18-21-22(16)30-13-19(17-5-3-4-8-25-17)29(21)23(26-18)28-11-9-24-10-12-28/h3-8,19,24H,9-13H2,1-2H3/t19-/m1/s1	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
TBA					Assay Description Table 12: 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 ...				Citation and Details BindingDB Entry DOI: 10.7270/Q20R9T84
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [342-460] (Homo sapiens (Human))	BDBM318609 ((4S)-7-(3,5-Dimethylisoxazol-4-yl)-2-piperazin-1-y...) Show SMILES Cc1noc(C)c1-c1ccc2nc(N3CCNCC3)n3[C@H](COc1c23)c1ccccn1 |r,wD:20.29,(-1.03,-6.16,;-2.36,-5.39,;-3.83,-5.87,;-4.73,-4.62,;-3.83,-3.37,;-4.6,-2.04,;-2.36,-3.85,;-1.03,-3.08,;.3,-3.85,;1.64,-3.08,;1.64,-1.54,;2.41,-.21,;1.64,1.13,;2.41,2.46,;3.96,2.46,;4.73,3.79,;3.96,5.13,;2.42,5.13,;1.65,3.79,;.3,.77,;-1.03,1.54,;-2.36,.77,;-2.36,-.77,;-1.03,-1.54,;.3,-.77,;-1.03,3.08,;-2.36,3.85,;-2.36,5.39,;-1.03,6.16,;.3,5.39,;.3,3.85,)| Show InChI InChI=1S/C23H24N6O2/c1-14-20(15(2)31-27-14)16-6-7-18-21-22(16)30-13-19(17-5-3-4-8-25-17)29(21)23(26-18)28-11-9-24-10-12-28/h3-8,19,24H,9-13H2,1-2H3/t19-/m1/s1	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 [58-164] (Homo sapiens (Human))	BDBM318609 ((4S)-7-(3,5-Dimethylisoxazol-4-yl)-2-piperazin-1-y...) Show SMILES Cc1noc(C)c1-c1ccc2nc(N3CCNCC3)n3[C@H](COc1c23)c1ccccn1 |r,wD:20.29,(-1.03,-6.16,;-2.36,-5.39,;-3.83,-5.87,;-4.73,-4.62,;-3.83,-3.37,;-4.6,-2.04,;-2.36,-3.85,;-1.03,-3.08,;.3,-3.85,;1.64,-3.08,;1.64,-1.54,;2.41,-.21,;1.64,1.13,;2.41,2.46,;3.96,2.46,;4.73,3.79,;3.96,5.13,;2.42,5.13,;1.65,3.79,;.3,.77,;-1.03,1.54,;-2.36,.77,;-2.36,-.77,;-1.03,-1.54,;.3,-.77,;-1.03,3.08,;-2.36,3.85,;-2.36,5.39,;-1.03,6.16,;.3,5.39,;.3,3.85,)| Show InChI InChI=1S/C23H24N6O2/c1-14-20(15(2)31-27-14)16-6-7-18-21-22(16)30-13-19(17-5-3-4-8-25-17)29(21)23(26-18)28-11-9-24-10-12-28/h3-8,19,24H,9-13H2,1-2H3/t19-/m1/s1	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
TBA					Assay Description Table 11: 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 ...				Citation and Details BindingDB Entry DOI: 10.7270/Q20R9T84
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [42-168] (Homo sapiens (Human))	BDBM318609 ((4S)-7-(3,5-Dimethylisoxazol-4-yl)-2-piperazin-1-y...) Show SMILES Cc1noc(C)c1-c1ccc2nc(N3CCNCC3)n3[C@H](COc1c23)c1ccccn1 |r,wD:20.29,(-1.03,-6.16,;-2.36,-5.39,;-3.83,-5.87,;-4.73,-4.62,;-3.83,-3.37,;-4.6,-2.04,;-2.36,-3.85,;-1.03,-3.08,;.3,-3.85,;1.64,-3.08,;1.64,-1.54,;2.41,-.21,;1.64,1.13,;2.41,2.46,;3.96,2.46,;4.73,3.79,;3.96,5.13,;2.42,5.13,;1.65,3.79,;.3,.77,;-1.03,1.54,;-2.36,.77,;-2.36,-.77,;-1.03,-1.54,;.3,-.77,;-1.03,3.08,;-2.36,3.85,;-2.36,5.39,;-1.03,6.16,;.3,5.39,;.3,3.85,)| Show InChI InChI=1S/C23H24N6O2/c1-14-20(15(2)31-27-14)16-6-7-18-21-22(16)30-13-19(17-5-3-4-8-25-17)29(21)23(26-18)28-11-9-24-10-12-28/h3-8,19,24H,9-13H2,1-2H3/t19-/m1/s1	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