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BDBM220684 US9296741, 273

SMILES: CN(C)S(=O)(=O)c1ccc(OCC2CC2)c(c1)-c1cn(C)c(=O)c2[nH]ccc12

InChI Key: InChIKey=OBDABMYIQCEIPF-UHFFFAOYSA-N

Data: 2 KI

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 = 220684   
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 (BRD4)


(Homo sapiens (Human))
BDBM220684
PNG
(US9296741, 273)
Show SMILES CN(C)S(=O)(=O)c1ccc(OCC2CC2)c(c1)-c1cn(C)c(=O)c2[nH]ccc12
Show InChI InChI=1S/C20H23N3O4S/c1-22(2)28(25,26)14-6-7-18(27-12-13-4-5-13)16(10-14)17-11-23(3)20(24)19-15(17)8-9-21-19/h6-11,13,21H,4-5,12H2,1-3H3
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
1.20n/an/an/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
A time-resolved fluorescence resonance energy transfer (TR-FRET) assay was used to determine the affinities of compounds of the Examples listed in Ta...


US Patent US9296741 (2016)


BindingDB Entry DOI: 10.7270/Q26W98ZQ
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4 (BRD4)


(Homo sapiens (Human))
BDBM220684
PNG
(US9296741, 273)
Show SMILES CN(C)S(=O)(=O)c1ccc(OCC2CC2)c(c1)-c1cn(C)c(=O)c2[nH]ccc12
Show InChI InChI=1S/C20H23N3O4S/c1-22(2)28(25,26)14-6-7-18(27-12-13-4-5-13)16(10-14)17-11-23(3)20(24)19-15(17)8-9-21-19/h6-11,13,21H,4-5,12H2,1-3H3
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
1.30n/an/an/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
A time-resolved fluorescence resonance energy transfer (TR-FRET) assay was used to determine the affinities of compounds of the Examples listed in Ta...


US Patent US9296741 (2016)


BindingDB Entry DOI: 10.7270/Q26W98ZQ
More data for this
Ligand-Target Pair