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BDBM333409 4-[5-(2,4-Difluorophenoxy)-1H-benzimidazol-6-yl]-6-methyl-1,6-dihydro-7H-pyrrolo[2,3-c]pyridin-7-one trifluoroacetate::US9737516, Example 5

SMILES: Cn1cc(-c2cc3[nH]cnc3cc2Oc2ccc(F)cc2F)c2cc[nH]c2c1=O

InChI Key: InChIKey=PZPORIITKJZIMN-ZACQAIPSSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 333409   
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))
BDBM333409
PNG
(4-[5-(2,4-Difluorophenoxy)-1H-benzimidazol-6-yl]-6...)
Show SMILES Cn1cc(-c2cc3[nH]cnc3cc2Oc2ccc(F)cc2F)c2cc[nH]c2c1=O
Show InChI InChI=1S/C18H17Cl2N3O2S/c19-11-3-1-2-10(4-11)6-21-13-5-12(20)8-23-14(7-22-18(13)23)17-16(25)15(24)9-26-17/h1-5,7-8,15-17,21,24-25H,6,9H2/t15-,16-,17+/m1/s1
GoogleScholar
PC cid
PC sid
UniChem
Article
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)


Article DOI: 10.1021/jm060727j
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 Bromo 1 domain(BRD4 BD1)


(Homo sapiens (Human))
BDBM333409
PNG
(4-[5-(2,4-Difluorophenoxy)-1H-benzimidazol-6-yl]-6...)
Show SMILES Cn1cc(-c2cc3[nH]cnc3cc2Oc2ccc(F)cc2F)c2cc[nH]c2c1=O
Show InChI InChI=1S/C18H17Cl2N3O2S/c19-11-3-1-2-10(4-11)6-21-13-5-12(20)8-23-14(7-22-18(13)23)17-16(25)15(24)9-26-17/h1-5,7-8,15-17,21,24-25H,6,9H2/t15-,16-,17+/m1/s1
GoogleScholar
PC cid
PC sid
UniChem
Article
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)


Article DOI: 10.1021/jm060727j
More data for this
Ligand-Target Pair