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BDBM333414 4-[6-(2,4-Difluorophenoxy)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]-6-methyl-1,6-dihydro-7H-pyrazolo[3,4-c]pyridin-7-one::US9737516, Example 10

SMILES: Cn1c2cc(Oc3ccc(F)cc3F)c(cc2n(C)c1=O)-c1cn(C)c(=O)c2[nH]ncc12

InChI Key: InChIKey=MLDCAWAMPZSSGM-MAZHCROVSA-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 = 333414   
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 protein 4 Bromo 2 domain(BRD4 BD2)


(Homo sapiens (Human))
BDBM333414
PNG
(4-[6-(2,4-Difluorophenoxy)-1,3-dimethyl-2-oxo-2,3-...)
Show SMILES Cn1c2cc(Oc3ccc(F)cc3F)c(cc2n(C)c1=O)-c1cn(C)c(=O)c2[nH]ncc12
Show InChI InChI=1S/C18H18ClFN4O2/c19-11-1-3-13(20)10(7-11)8-22-17-18-23-9-14(24(18)6-5-21-17)12-2-4-15(25)16(12)26/h1,3,5-7,9,12,15-16,25-26H,2,4,8H2,(H,21,22)/t12-,15+,16-/m0/s1
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



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 20 μL for BD1 and 40 μL for BD2. Inhib...


US Patent US9737516 (2017)

More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 Bromo 1 domain(BRD4 BD1)


(Homo sapiens (Human))
BDBM333414
PNG
(4-[6-(2,4-Difluorophenoxy)-1,3-dimethyl-2-oxo-2,3-...)
Show SMILES Cn1c2cc(Oc3ccc(F)cc3F)c(cc2n(C)c1=O)-c1cn(C)c(=O)c2[nH]ncc12
Show InChI InChI=1S/C18H18ClFN4O2/c19-11-1-3-13(20)10(7-11)8-22-17-18-23-9-14(24(18)6-5-21-17)12-2-4-15(25)16(12)26/h1,3,5-7,9,12,15-16,25-26H,2,4,8H2,(H,21,22)/t12-,15+,16-/m0/s1
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



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 20 μL for BD1 and 40 μL for BD2. Inhib...


US Patent US9737516 (2017)

More data for this
Ligand-Target Pair