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Compile Data Set for Download or QSAR

Found 127 hits of ic50 for UniProtKB: P04049   
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
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210020
PNG
(US10576087, Compound 2.26 | US9273046, 2.26 | US98...)
Show SMILES Clc1cccc2nc([nH]c12)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a<0.25n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210021
PNG
(US10576087, Compound 2.27 | US9273046, 2.27 | US98...)
Show SMILES Oc1ccc2nc([nH]c2c1)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

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AffyNet 
PC cid
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UniChem
US Patent
n/an/a<0.25n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210051
PNG
(US10576087, Compound 2.29 | US9273046, 2.29 | US98...)
Show SMILES O=C1CCc2c(Oc3ccc4OC5C(C5c4c3)c3nc(no3)-c3ccccc3)ccnc2N1
Show InChI InChI=1S/C25H18N4O4/c30-19-9-7-15-18(10-11-26-24(15)27-19)31-14-6-8-17-16(12-14)20-21(22(20)32-17)25-28-23(29-33-25)13-4-2-1-3-5-13/h1-6,8,10-12,20-22H,7,9H2,(H,26,27,30)
PDB

UniProtKB/SwissProt

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AffyNet 
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UniChem
US Patent
n/an/a<0.25n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM373010
PNG
(US9895376, Compound 2.30)
Show SMILES O=C(COC(=O)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12)c1ccccc1
Show InChI InChI=1S/C26H20N2O6/c29-18(14-4-2-1-3-5-14)13-32-26(31)23-22-17-12-15(6-8-19(17)34-24(22)23)33-20-10-11-27-25-16(20)7-9-21(30)28-25/h1-6,8,10-12,22-24H,7,9,13H2,(H,27,28,30)
PDB

UniProtKB/SwissProt

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UniChem
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n/an/a<0.25n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210037
PNG
(US10576087, Compound 2.1 | US9273046, 2.1 | US9895...)
Show SMILES O=C1CCc2c(Oc3ccc4OC5C(C5c4c3)c3nc4ccccc4[nH]3)ccnc2N1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.300n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210022
PNG
(US10576087, Compound 2.31 | US9273046, 2.31 | US98...)
Show SMILES O=C1CCc2c(Oc3ccc4OC5C(C5c4c3)c3nc(c[nH]3)-c3ccncc3)ccnc2N1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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UniChem
US Patent
n/an/a 0.350n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210015
PNG
(US10576087, Compound 2.21 | US9273046, 2.21 | US98...)
Show SMILES O=C1CCc2c(Oc3ccc4OC5C(C5c4c3)c3nc4cc5CCCc5cc4[nH]3)ccnc2N1
PDB

UniProtKB/SwissProt

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UniChem
US Patent
n/an/a 0.400n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322528
PNG
(5-[3-[4-(3-thienyl)-1H-imidazol-2-yl]chroman-6-yl]...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3ccsc3)ccnc2N1
PDB

UniProtKB/SwissProt

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US Patent
n/an/a 0.400n/an/an/an/an/an/a



Redx Pharma PLC

US Patent




US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322529
PNG
(5-[3-[4-(2-thienyl)-1H-imidazol-2-yl]chroman-6-yl]...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3cccs3)ccnc2N1
PDB

UniProtKB/SwissProt

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US Patent
n/an/a 0.5n/an/an/an/an/an/a



Redx Pharma PLC

US Patent




US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM372977
PNG
(US10576087, Compound 2.4a | US9895376, Compound 2....)
Show SMILES Cc1cc2[nH]c(nc2cc1F)[C@@H]1[C@H]2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3[C@@H]12 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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PC sid
UniChem
US Patent
n/an/a 0.540n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210044
PNG
(US10576087, Compound 2.4 | US9273046, 2.4 | US9895...)
Show SMILES Cc1cc2[nH]c(nc2cc1F)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

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AffyNet 
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UniChem
US Patent
n/an/a<0.560n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322521
PNG
(5-[3-(4-phenyl-1H-imidazol-2-yl)chroman-6-yl]oxy-3...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3ccccc3)ccnc2N1
PDB

UniProtKB/SwissProt

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US Patent
n/an/a 0.600n/an/an/an/an/an/a



Redx Pharma PLC

US Patent




US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210024
PNG
(US10576087, Compound 2.33 | US9273046, 2.33 | US98...)
Show SMILES FC(F)(F)c1c[nH]c(n1)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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PC sid
UniChem
US Patent
n/an/a 0.600n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210002
PNG
(US10576087, Compound 2.8 | US9273046, 2.8 | US9895...)
Show SMILES Cc1ccc2nc([nH]c2c1)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.710n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322521
PNG
(5-[3-(4-phenyl-1H-imidazol-2-yl)chroman-6-yl]oxy-3...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3ccccc3)ccnc2N1
PDB

UniProtKB/SwissProt

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UniChem
US Patent
n/an/a 0.800n/an/an/an/an/an/a



Redx Pharma PLC

US Patent




US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210023
PNG
(US10576087, Compound 2.32 | US9273046, 2.32 | US98...)
Show SMILES Clc1ccccc1-c1c[nH]c(n1)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.900n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322521
PNG
(5-[3-(4-phenyl-1H-imidazol-2-yl)chroman-6-yl]oxy-3...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3ccccc3)ccnc2N1
PDB

UniProtKB/SwissProt

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n/an/a 1n/an/an/an/an/an/a



Redx Pharma PLC

US Patent




US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210016
PNG
(US10576087, Compound 2.22 | US9273046, 2.22 | US98...)
Show SMILES NC(=O)c1ccc2nc([nH]c2c1)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

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n/an/a 1n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM372967
PNG
(US10576087, Compound 2.2a | US9895376, Compound 2....)
Show SMILES FC(F)(F)c1ccc2nc([nH]c2c1)[C@H]1[C@@H]2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3[C@H]12 |r|
PDB

UniProtKB/SwissProt

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MCE
PC cid
PC sid
UniChem
US Patent
n/an/a 1.20n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210038
PNG
(US10576087, Compound 2.2 | US9273046, 2.2 | US9895...)
Show SMILES FC(F)(F)c1ccc2nc([nH]c2c1)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

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PC cid
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UniChem
US Patent
n/an/a 1.40n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210034
PNG
(US10576087, Compound 1.1 | US9273046, 1.1 | US9895...)
Show SMILES O=C1CCc2c(Oc3ccc4CC5C(C5c4c3)c3nc4ccccc4[nH]3)ccnc2N1
PDB

UniProtKB/SwissProt

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n/an/a 1.40n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210013
PNG
(US10576087, Compound 2.19 | US9273046, 2.19 | US98...)
Show SMILES Fc1cccc2nc([nH]c12)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

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n/an/a 1.60n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210007
PNG
(US10576087, Compound 2.13 | US9273046, 2.13 | US98...)
Show SMILES Brc1ccc2nc([nH]c2c1)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

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UniChem
US Patent
n/an/a 1.70n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210001
PNG
(US10576087, Compound 2.7 | US9273046, 2.7 | US9895...)
Show SMILES Fc1ccc2nc([nH]c2c1)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

UniProtKB/SwissProt

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UniChem
US Patent
n/an/a 2.10n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM372985
PNG
(US10576087, Compound 2.5b | US9895376, Compound 2....)
Show SMILES FC(F)(F)c1cc2[nH]c(nc2cc1Cl)[C@H]1[C@@H]2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3[C@H]12 |r|
PDB

UniProtKB/SwissProt

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UniChem
US Patent
n/an/a 2.5n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM372978
PNG
(US10576087, Compound 2.4b | US9895376, Compound 2....)
Show SMILES Cc1cc2[nH]c(nc2cc1F)[C@H]1[C@@H]2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3[C@H]12 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
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PC sid
UniChem
US Patent
n/an/a 2.5n/an/an/an/an/an/a



Research Triangle Institute



Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM622280
PNG
(4-amino-N-(1-((2-fluorophenyl)amino)-6-methylisoqu...)
Show SMILES COc1ccc(CNc2ncnc3c(cccc23)C(=O)Nc2c(C)ccc3c(Nc4ccccc4F)nccc23)c(OC)c1
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Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM622284
PNG
(4-amino-N-(1-((3-chloro-4-fluorophenyl)amino)-6-me...)
Show SMILES Cc1ccc2c(Nc3ccc(F)c(Cl)c3)nccc2c1NC(=O)c1cnc2c(N)ncnn12
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More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM238347
PNG
(US9388165, 3)
Show SMILES Cc1ccc(cc1NC(=O)c1cccc2c(N)nccc12)C(=O)Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C25H19F3N4O2/c1-14-8-9-15(23(33)31-17-5-2-4-16(13-17)25(26,27)28)12-21(14)32-24(34)20-7-3-6-19-18(20)10-11-30-22(19)29/h2-13H,1H3,(H2,29,30)(H,31,33)(H,32,34)
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HANMI PHARM. CO., LTD.

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Assay Description
The compounds prepared in Examples were tested for inhibitory activities against three subtypes of RAF, i.e. RAF1 Y340D Y341D, BRAF normal type and B...


US Patent US9388165 (2016)


BindingDB Entry DOI: 10.7270/Q2F76BF9
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM372973
PNG
(US10576087, Compound 2.3b | US9895376, Compound 2....)
Show SMILES Clc1cc2nc([nH]c2cc1Cl)[C@H]1[C@@H]2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3[C@H]12 |r|
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Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM622285
PNG
(4-amino-N-(1-((2-fluoro-4-methoxyphenyl)amino)-6-m...)
Show SMILES COc1ccc(Nc2nccc3c(NC(=O)c4cccc5c(NCc6ccc(OC)cc6OC)ncnc45)c(C)ccc23)c(F)c1
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More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210032
PNG
(US10576087, Compound 3.7 | US9273046, 3.7 | US9895...)
Show SMILES FC(F)(F)c1ccc2nc([nH]c2c1)C1C2Oc3ccc(Oc4ccnc5NC(=O)OCc45)cc3C12
PDB

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Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210005
PNG
(US10576087, Compound 2.11 | US9273046, 2.11 | US98...)
Show SMILES Fc1cc2nc([nH]c2cc1F)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

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Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM622277
PNG
(4-amino-N-(1-(4-chloro-2-fluorobenzoyl)-6-methylis...)
Show SMILES Cc1ccc2c(nccc2c1NC(=O)c1csc2c(N)ncnc12)C(O)c1ccc(Cl)cc1F
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More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210009
PNG
(US10576087, Compound 2.15 | US9273046, 2.15 | US98...)
Show SMILES Cn1c(nc2ccccc12)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
Show InChI InChI=1S/C25H20N4O3/c1-29-17-5-3-2-4-16(17)27-25(29)22-21-15-12-13(6-8-18(15)32-23(21)22)31-19-10-11-26-24-14(19)7-9-20(30)28-24/h2-6,8,10-12,21-23H,7,9H2,1H3,(H,26,28,30)
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Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM210010
PNG
(US10576087, Compound 2.16 | US9273046, 2.16 | US98...)
Show SMILES COc1ccc2nc([nH]c2c1)C1C2Oc3ccc(Oc4ccnc5NC(=O)CCc45)cc3C12
PDB

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Assay Description
Compounds disclosed herein were tested against B-Raf (V600E) (PV3849, from Invitrogen) or C-Raf (Y340D/Y341D) (PV3805, from Invitrogen) in a time-res...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2V40XG6
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM622276
PNG
(4-amino-N-(6-methyl-1-(3-(trifluoromethyl)benzoyl)...)
Show SMILES Cc1ccc2c(nccc2c1NC(=O)c1csc2c(N)ncnc12)C(O)c1cccc(c1)C(F)(F)F
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More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322533
PNG
(5-[3-[5-(3-pyridyl)-1H-imidazol-2-yl]chroman-6-yl]...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3ncc([nH]3)-c3cccnc3)ccnc2N1
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Redx Pharma PLC

US Patent




US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322532
PNG
(5-[3-[4-(benzofuran-3-yl)-1H-imidazol-2-yl]chroman...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3coc4ccccc34)ccnc2N1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322531
PNG
(5-[3-[5-(3-chlorophenyl)-1H-imidazol-2-yl]chroman-...)
Show SMILES Clc1cccc(c1)-c1cnc([nH]1)C1COc2ccc(Oc3ccnc4NC(=O)CCc34)cc2C1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322530
PNG
(5-[3-[5-(2-chlorophenyl)-1H-imidazol-2-yl]chroman-...)
Show SMILES Clc1ccccc1-c1cnc([nH]1)C1COc2ccc(Oc3ccnc4NC(=O)CCc34)cc2C1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322529
PNG
(5-[3-[4-(2-thienyl)-1H-imidazol-2-yl]chroman-6-yl]...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3cccs3)ccnc2N1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322528
PNG
(5-[3-[4-(3-thienyl)-1H-imidazol-2-yl]chroman-6-yl]...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3ccsc3)ccnc2N1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322527
PNG
(5-[3-(4-tert-butyl-1H-imidazol-2-yl)chroman-6-yl]o...)
Show SMILES CC(C)(C)c1c[nH]c(n1)C1COc2ccc(Oc3ccnc4NC(=O)CCc34)cc2C1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322525
PNG
(5-[3[4-(4-pyridyl)-1H-imidazol-2-yl]chroman-6-yl]o...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3ccncc3)ccnc2N1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322521
PNG
(5-[3-(4-phenyl-1H-imidazol-2-yl)chroman-6-yl]oxy-3...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3ccccc3)ccnc2N1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322521
PNG
(5-[3-(4-phenyl-1H-imidazol-2-yl)chroman-6-yl]oxy-3...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3nc(c[nH]3)-c3ccccc3)ccnc2N1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322535
PNG
(5-[3-[5-(4-fluorophenyl)-1H-imidazol-2-yl]chroman-...)
Show SMILES Fc1ccc(cc1)-c1cnc([nH]1)C1COc2ccc(Oc3ccnc4NC(=O)CCc34)cc2C1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322536
PNG
(5-[3-[5-(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]ch...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3ncc([nH]3)-c3ccc4OCOc4c3)ccnc2N1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase [Y340D,Y341D]


(Homo sapiens (Human))
BDBM322537
PNG
(5-[3-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-imid...)
Show SMILES O=C1CCc2c(Oc3ccc4OCC(Cc4c3)c3ncc([nH]3)-c3ccc4OCCOc4c3)ccnc2N1
PDB

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US Patent US10183939 (2019)


BindingDB Entry DOI: 10.7270/Q2QN68WX
More data for this
Ligand-Target Pair
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