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Compile Data Set for Download or QSAR

Found 7 hits Enz. Inhib. hit(s) with Target = 'RAF-1'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
RAF-1


(Homo sapiens (human))
BDBM16673
PNG
(4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamo...)
Show SMILES CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1
Show InChI InChI=1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)
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Article
PubMed
n/an/a 6n/an/an/an/a8.232



Bayer Pharmaceuticals Corporation



Assay Description
The biochemical activity of compound was determined by incubation with Raf kinases and substrate MEK-1 in the presence of 1-10 uM ATP/ [gamma-32P] AT...


Cancer Res 64: 7099-109 (2004)


Article DOI: 10.1158/0008-5472.CAN-04-1443
BindingDB Entry DOI: 10.7270/Q2H70D2J
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Mus musculus)
BDBM50172061
PNG
(CHEMBL3805893)
Show SMILES C(Oc1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccc2OCCOc2c1)c1ccccc1
Show InChI InChI=1S/C30H26N2O3/c1-3-7-22(8-4-1)21-35-26-14-11-23(12-15-26)28-20-27(31-32(28)25-9-5-2-6-10-25)24-13-16-29-30(19-24)34-18-17-33-29/h1-16,19,28H,17-18,20-21H2
UniProtKB/TrEMBL

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PC sid
UniChem

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Article
PubMed
n/an/a 5.17E+3n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of mouse c-Raf assessed as reduction in human full length N-terminal His-tagged MEK1 phosphorylation pre-incubated for 1 hr before MEK1 ad...


Bioorg Med Chem 24: 3052-3061 (2016)


Article DOI: 10.1016/j.bmc.2016.05.012
BindingDB Entry DOI: 10.7270/Q2HX1FKZ
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Mus musculus)
BDBM50172062
PNG
(CHEMBL3806108)
Show SMILES CN(C)c1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccc2OCCOc2c1
Show InChI InChI=1S/C25H25N3O2/c1-27(2)20-11-8-18(9-12-20)23-17-22(26-28(23)21-6-4-3-5-7-21)19-10-13-24-25(16-19)30-15-14-29-24/h3-13,16,23H,14-15,17H2,1-2H3
UniProtKB/TrEMBL

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UniChem

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Article
PubMed
n/an/a 5.48E+3n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of mouse c-Raf assessed as reduction in human full length N-terminal His-tagged MEK1 phosphorylation pre-incubated for 1 hr before MEK1 ad...


Bioorg Med Chem 24: 3052-3061 (2016)


Article DOI: 10.1016/j.bmc.2016.05.012
BindingDB Entry DOI: 10.7270/Q2HX1FKZ
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Mus musculus)
BDBM50172059
PNG
(CHEMBL3805508)
Show SMILES C(Oc1cccc(c1)C1CC(=NN1c1ccccc1)c1ccc2OCCOc2c1)c1ccccc1
Show InChI InChI=1S/C30H26N2O3/c1-3-8-22(9-4-1)21-35-26-13-7-10-24(18-26)28-20-27(31-32(28)25-11-5-2-6-12-25)23-14-15-29-30(19-23)34-17-16-33-29/h1-15,18-19,28H,16-17,20-21H2
UniProtKB/TrEMBL

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Article
PubMed
n/an/a 6.80E+3n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of mouse c-Raf assessed as reduction in human full length N-terminal His-tagged MEK1 phosphorylation pre-incubated for 1 hr before MEK1 ad...


Bioorg Med Chem 24: 3052-3061 (2016)


Article DOI: 10.1016/j.bmc.2016.05.012
BindingDB Entry DOI: 10.7270/Q2HX1FKZ
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Mus musculus)
BDBM50172063
PNG
(CHEMBL3805849)
Show SMILES Clc1ccc(cc1Cl)C1CC(=NN1c1ccccc1)c1ccc2OCCOc2c1
Show InChI InChI=1S/C23H18Cl2N2O2/c24-18-8-6-16(12-19(18)25)21-14-20(26-27(21)17-4-2-1-3-5-17)15-7-9-22-23(13-15)29-11-10-28-22/h1-9,12-13,21H,10-11,14H2
UniProtKB/TrEMBL

GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 8.35E+3n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of mouse c-Raf assessed as reduction in human full length N-terminal His-tagged MEK1 phosphorylation pre-incubated for 1 hr before MEK1 ad...


Bioorg Med Chem 24: 3052-3061 (2016)


Article DOI: 10.1016/j.bmc.2016.05.012
BindingDB Entry DOI: 10.7270/Q2HX1FKZ
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Mus musculus)
BDBM50172060
PNG
(CHEMBL3805409)
Show SMILES Clc1cccc(c1)C1CC(=NN1c1ccccc1)c1ccc2OCCOc2c1
Show InChI InChI=1S/C23H19ClN2O2/c24-18-6-4-5-17(13-18)21-15-20(25-26(21)19-7-2-1-3-8-19)16-9-10-22-23(14-16)28-12-11-27-22/h1-10,13-14,21H,11-12,15H2
UniProtKB/TrEMBL

GoogleScholar
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.46E+4n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of mouse c-Raf assessed as reduction in human full length N-terminal His-tagged MEK1 phosphorylation pre-incubated for 1 hr before MEK1 ad...


Bioorg Med Chem 24: 3052-3061 (2016)


Article DOI: 10.1016/j.bmc.2016.05.012
BindingDB Entry DOI: 10.7270/Q2HX1FKZ
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Mus musculus)
BDBM50172058
PNG
(CHEMBL3805675)
Show SMILES COc1cccc(c1)C1CC(=NN1c1ccccc1)c1ccc2OCCOc2c1
Show InChI InChI=1S/C24H22N2O3/c1-27-20-9-5-6-18(14-20)22-16-21(25-26(22)19-7-3-2-4-8-19)17-10-11-23-24(15-17)29-13-12-28-23/h2-11,14-15,22H,12-13,16H2,1H3
UniProtKB/TrEMBL

GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 2.28E+4n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of mouse c-Raf assessed as reduction in human full length N-terminal His-tagged MEK1 phosphorylation pre-incubated for 1 hr before MEK1 ad...


Bioorg Med Chem 24: 3052-3061 (2016)


Article DOI: 10.1016/j.bmc.2016.05.012
BindingDB Entry DOI: 10.7270/Q2HX1FKZ
More data for this
Ligand-Target Pair