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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'RAF proto-oncogene serine/threonine-protein kinase' and Ligand = 'BDBM88106'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
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