BindingDB logo
myBDB logout

1 similar compounds to monomer 87568

Compile data set for download or QSAR
Wt: 483.5
BDBM88106

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 88106   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
B-RAF V600E


(Homo sapiens (Human))
BDBM88106
PNG
(US10245267, Example 1143 | US10709712, Example 114...)
Show SMILES CCOc1cc(cc(n1)N1CCOCC1)-c1cc(NC(=O)c2ccnc(c2)C(C)(F)F)cnc1C
Show InChI InChI=1S/C25H27F2N5O3/c1-4-35-23-13-18(12-22(31-23)32-7-9-34-10-8-32)20-14-19(15-29-16(20)2)30-24(33)17-5-6-28-21(11-17)25(3,26)27/h5-6,11-15H,4,7-10H2,1-3H3,(H,30,33)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.81n/an/an/an/a7.525



Novartis AG

US Patent


Assay Description
Raf and biotinylated Mek, kinase dead, were combined at 2x final concentrations in assay buffer (50 mM Tris, pH 7.5, 15 mM MgCl2, 0.01% BSA and 1 mM ...


US Patent US9694016 (2017)


BindingDB Entry DOI: 10.7270/Q2MC8X6W
More data for this
Ligand-Target Pair
C-RAF


(Homo sapiens (Human))
BDBM88106
PNG
(US10245267, Example 1143 | US10709712, Example 114...)
Show SMILES CCOc1cc(cc(n1)N1CCOCC1)-c1cc(NC(=O)c2ccnc(c2)C(C)(F)F)cnc1C
Show InChI InChI=1S/C25H27F2N5O3/c1-4-35-23-13-18(12-22(31-23)32-7-9-34-10-8-32)20-14-19(15-29-16(20)2)30-24(33)17-5-6-28-21(11-17)25(3,26)27/h5-6,11-15H,4,7-10H2,1-3H3,(H,30,33)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 0.540n/an/an/an/a7.525



Novartis AG

US Patent


Assay Description
Raf and biotinylated Mek, kinase dead, were combined at 2x final concentrations in assay buffer (50 mM Tris, pH 7.5, 15 mM MgCl2, 0.01% BSA and 1 mM ...


US Patent US9694016 (2017)


BindingDB Entry DOI: 10.7270/Q2MC8X6W
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM88106
PNG
(US10245267, Example 1143 | US10709712, Example 114...)
Show SMILES CCOc1cc(cc(n1)N1CCOCC1)-c1cc(NC(=O)c2ccnc(c2)C(C)(F)F)cnc1C
Show InChI InChI=1S/C25H27F2N5O3/c1-4-35-23-13-18(12-22(31-23)32-7-9-34-10-8-32)20-14-19(15-29-16(20)2)30-24(33)17-5-6-28-21(11-17)25(3,26)27/h5-6,11-15H,4,7-10H2,1-3H3,(H,30,33)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 0.540n/an/an/an/an/an/a



NOVARTIS AG

US Patent


Assay Description
C-Raf TR refers to a truncated C-Raf protein, a Δ1-324 deletion mutant.C-Raf FL refers to the full-length C-Raf protein.Full length MEK1 with an...


US Patent US10709712 (2020)

More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM88106
PNG
(US10245267, Example 1143 | US10709712, Example 114...)
Show SMILES CCOc1cc(cc(n1)N1CCOCC1)-c1cc(NC(=O)c2ccnc(c2)C(C)(F)F)cnc1C
Show InChI InChI=1S/C25H27F2N5O3/c1-4-35-23-13-18(12-22(31-23)32-7-9-34-10-8-32)20-14-19(15-29-16(20)2)30-24(33)17-5-6-28-21(11-17)25(3,26)27/h5-6,11-15H,4,7-10H2,1-3H3,(H,30,33)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 0.540n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Raf and biotinylated Mek, kinase dead, were combined at 2 final concentrations in assay buffer (50 mM Tris, pH 7.5, 15 mM MgCl2, 0.01% BSA and 1 mM ...


US Patent US10245267 (2019)


BindingDB Entry DOI: 10.7270/Q2RB76WP
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM88106
PNG
(US10245267, Example 1143 | US10709712, Example 114...)
Show SMILES CCOc1cc(cc(n1)N1CCOCC1)-c1cc(NC(=O)c2ccnc(c2)C(C)(F)F)cnc1C
Show InChI InChI=1S/C25H27F2N5O3/c1-4-35-23-13-18(12-22(31-23)32-7-9-34-10-8-32)20-14-19(15-29-16(20)2)30-24(33)17-5-6-28-21(11-17)25(3,26)27/h5-6,11-15H,4,7-10H2,1-3H3,(H,30,33)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.81n/an/an/an/an/an/a



NOVARTIS AG

US Patent


Assay Description
C-Raf TR refers to a truncated C-Raf protein, a Δ1-324 deletion mutant.C-Raf FL refers to the full-length C-Raf protein.Full length MEK1 with an...


US Patent US10709712 (2020)

More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM88106
PNG
(US10245267, Example 1143 | US10709712, Example 114...)
Show SMILES CCOc1cc(cc(n1)N1CCOCC1)-c1cc(NC(=O)c2ccnc(c2)C(C)(F)F)cnc1C
Show InChI InChI=1S/C25H27F2N5O3/c1-4-35-23-13-18(12-22(31-23)32-7-9-34-10-8-32)20-14-19(15-29-16(20)2)30-24(33)17-5-6-28-21(11-17)25(3,26)27/h5-6,11-15H,4,7-10H2,1-3H3,(H,30,33)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.81n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Raf and biotinylated Mek, kinase dead, were combined at 2 final concentrations in assay buffer (50 mM Tris, pH 7.5, 15 mM MgCl2, 0.01% BSA and 1 mM ...


US Patent US10245267 (2019)


BindingDB Entry DOI: 10.7270/Q2RB76WP
More data for this
Ligand-Target Pair