BindingDB logo
myBDB logout

BDBM349240 (4R)-4-methyl-6-[(E)-2-::US10206931, Example 47

SMILES: C[C@@H]1CC(=O)Nc2cccc(\C=C(/C)c3ccccc3)c2N1

InChI Key: InChIKey=BACDLUMKKBRJFU-YPDDLIOESA-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 = 349240   
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
BRD4 BD1 (aa 42-168)


(Homo sapiens (Human))
BDBM349240
PNG
((4R)-4-methyl-6-[(E)-2- | US10206931, Example 47)
Show SMILES C[C@@H]1CC(=O)Nc2cccc(\C=C(/C)c3ccccc3)c2N1
Show InChI InChI=1S/C19H20N2O/c1-13(15-7-4-3-5-8-15)11-16-9-6-10-17-19(16)20-14(2)12-18(22)21-17/h3-11,14,20H,12H2,1-2H3,(H,21,22)/b13-11+/t14-/m1/s1
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 3.25E+3n/an/an/an/an/an/a



Genentech Inc

US Patent


Assay Description
His/Flag epitope tagged BRD4 BD142-168 was cloned, expressed, and purified to. BRD4 binding and inhibition was assessed by monitoring the engagement ...


US Patent US10206931 (2019)


BindingDB Entry DOI: 10.7270/Q2GM89FR
More data for this
Ligand-Target Pair
CREB-binding protein


(Homo sapiens (Human))
BDBM349240
PNG
((4R)-4-methyl-6-[(E)-2- | US10206931, Example 47)
Show SMILES C[C@@H]1CC(=O)Nc2cccc(\C=C(/C)c3ccccc3)c2N1
Show InChI InChI=1S/C19H20N2O/c1-13(15-7-4-3-5-8-15)11-16-9-6-10-17-19(16)20-14(2)12-18(22)21-17/h3-11,14,20H,12H2,1-2H3,(H,21,22)/b13-11+/t14-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 200n/an/an/an/an/an/a



Genentech Inc

US Patent


Assay Description
His/Flag epitope tagged CBP was cloned, expressed, and purified to homogeneity. CBP binding and inhibition was assessed by monitoring the engagement ...


US Patent US10206931 (2019)


BindingDB Entry DOI: 10.7270/Q2GM89FR
More data for this
Ligand-Target Pair