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BDBM318658 7-(3,5-dimethylisoxazol-4-yl)-N,N- dimethyl-4-pyridin-2-yl-4,5- dihydroimidazo[1,5,4- de][1,4]benzoxazin-2-amine::US9624241, Example 187

SMILES: CN(C)c1nc2ccc(-c3c(C)noc3C)c3OCC(c4ccccn4)n1c23

InChI Key: InChIKey=LEBOWCBCCBNYII-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 318658   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Bromodomain containing 4


(Homo sapiens (Human))
BDBM318658
PNG
(7-(3,5-dimethylisoxazol-4-yl)-N,N- dimethyl-4-pyri...)
Show SMILES CN(C)c1nc2ccc(-c3c(C)noc3C)c3OCC(c4ccccn4)n1c23
Show InChI InChI=1S/C21H21N5O2/c1-12-18(13(2)28-24-12)14-8-9-16-19-20(14)27-11-17(15-7-5-6-10-22-15)26(19)21(23-16)25(3)4/h5-10,17H,11H2,1-4H3
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/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)

More data for this
Ligand-Target Pair
Bromodomain containing 4


(Homo sapiens (Human))
BDBM318658
PNG
(7-(3,5-dimethylisoxazol-4-yl)-N,N- dimethyl-4-pyri...)
Show SMILES CN(C)c1nc2ccc(-c3c(C)noc3C)c3OCC(c4ccccn4)n1c23
Show InChI InChI=1S/C21H21N5O2/c1-12-18(13(2)28-24-12)14-8-9-16-19-20(14)27-11-17(15-7-5-6-10-22-15)26(19)21(23-16)25(3)4/h5-10,17H,11H2,1-4H3
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/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)

More data for this
Ligand-Target Pair