BindingDB logo
myBDB logout

BDBM322542 5-[[(3R)-3-(4-phenyl-1H-imidazol-2-yl)-2,3-dihydro-1,4-benzodioxin-6-yl]oxy]-3,4-dihydro-1H-1,8-naphthyridin-2-one::US10183939, Example 20

SMILES: O=C1CCc2c(Oc3ccc4OC[C@H](Oc4c3)c3nc(c[nH]3)-c3ccccc3)ccnc2N1

InChI Key: InChIKey=WUMUCWGEHRZJNE-QFIPXVFZSA-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 = 322542   
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
C-RAF (Y340D Y341D)


(Homo sapiens (Human))
BDBM322542
PNG
(5-[[(3R)-3-(4-phenyl-1H-imidazol-2-yl)-2,3-dihydro...)
Show SMILES O=C1CCc2c(Oc3ccc4OC[C@H](Oc4c3)c3nc(c[nH]3)-c3ccccc3)ccnc2N1
Show InChI InChI=1S/C25H20N4O4/c30-23-9-7-17-19(10-11-26-24(17)29-23)32-16-6-8-20-21(12-16)33-22(14-31-20)25-27-13-18(28-25)15-4-2-1-3-5-15/h1-6,8,10-13,22H,7,9,14H2,(H,27,28)(H,26,29,30)/t22-/m0/s1
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<4n/an/an/an/an/an/a



Redx Pharma PLC

US Patent




US Patent US10183939 (2019)

More data for this
Ligand-Target Pair
B-Raf (V600E)


(Homo sapiens (Human))
BDBM322542
PNG
(5-[[(3R)-3-(4-phenyl-1H-imidazol-2-yl)-2,3-dihydro...)
Show SMILES O=C1CCc2c(Oc3ccc4OC[C@H](Oc4c3)c3nc(c[nH]3)-c3ccccc3)ccnc2N1
Show InChI InChI=1S/C25H20N4O4/c30-23-9-7-17-19(10-11-26-24(17)29-23)32-16-6-8-20-21(12-16)33-22(14-31-20)25-27-13-18(28-25)15-4-2-1-3-5-15/h1-6,8,10-13,22H,7,9,14H2,(H,27,28)(H,26,29,30)/t22-/m0/s1
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<4n/an/an/an/an/an/a



Redx Pharma PLC

US Patent


Assay Description
To determine whether compounds bind to RAF kinases, they are tested in a competition binding assay. The Invitrogen LanthaScreen Eu binding assay invo...


US Patent US10183939 (2019)

More data for this
Ligand-Target Pair