BindingDB logo
myBDB logout

Patent code US8785459

Compile Data Set for Download or QSAR

Found 386 hits of Enzyme Inhibition Constant Data   
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
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127088
PNG
(US8785459, 163)
Show SMILES Oc1c(F)ccc(Nc2ncnc3ccc(cc23)-c2ccc3[nH]ncc3c2)c1F
Show InChI InChI=1S/C21H13F2N5O/c22-15-3-6-18(19(23)20(15)29)27-21-14-8-12(2-5-17(14)24-10-25-21)11-1-4-16-13(7-11)9-26-28-16/h1-10,29H,(H,26,28)(H,24,25,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 2.40n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127087
PNG
(US8785459, 162)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3ccc(F)c(O)c3F)c2c1
Show InChI InChI=1S/C21H15F2N3O3/c1-29-18-9-12(3-7-17(18)27)11-2-5-15-13(8-11)21(25-10-24-15)26-16-6-4-14(22)20(28)19(16)23/h2-10,27-28H,1H3,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 2.90n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127083
PNG
(US8785459, 158)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(F)cc3F)c2c1
Show InChI InChI=1S/C21H15F2N3O3/c1-29-20-7-12(3-5-18(20)27)11-2-4-16-13(6-11)21(25-10-24-16)26-17-9-19(28)15(23)8-14(17)22/h2-10,27-28H,1H3,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 3.80n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127087
PNG
(US8785459, 162)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3ccc(F)c(O)c3F)c2c1
Show InChI InChI=1S/C21H15F2N3O3/c1-29-18-9-12(3-7-17(18)27)11-2-5-15-13(8-11)21(25-10-24-15)26-16-6-4-14(22)20(28)19(16)23/h2-10,27-28H,1H3,(H,24,25,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 4.5n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127088
PNG
(US8785459, 163)
Show SMILES Oc1c(F)ccc(Nc2ncnc3ccc(cc23)-c2ccc3[nH]ncc3c2)c1F
Show InChI InChI=1S/C21H13F2N5O/c22-15-3-6-18(19(23)20(15)29)27-21-14-8-12(2-5-17(14)24-10-25-21)11-1-4-16-13(7-11)9-26-28-16/h1-10,29H,(H,26,28)(H,24,25,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 4.5n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127083
PNG
(US8785459, 158)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(F)cc3F)c2c1
Show InChI InChI=1S/C21H15F2N3O3/c1-29-20-7-12(3-5-18(20)27)11-2-4-16-13(6-11)21(25-10-24-16)26-17-9-19(28)15(23)8-14(17)22/h2-10,27-28H,1H3,(H,24,25,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 7.10n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127085
PNG
(US8785459, 160)
Show SMILES Oc1cc(Nc2ncnc3ccc(cc23)-c2ccc(Cl)cc2)c(F)cc1F
Show InChI InChI=1S/C20H12ClF2N3O/c21-13-4-1-11(2-5-13)12-3-6-17-14(7-12)20(25-10-24-17)26-18-9-19(27)16(23)8-15(18)22/h1-10,27H,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 8.90n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127084
PNG
(US8785459, 159)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(Cl)cc3F)c2c1
Show InChI InChI=1S/C21H15ClFN3O3/c1-29-20-7-12(3-5-18(20)27)11-2-4-16-13(6-11)21(25-10-24-16)26-17-9-19(28)14(22)8-15(17)23/h2-10,27-28H,1H3,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 11.1n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126983
PNG
(US8785459, 58)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)ccc3F)c2c1
Show InChI InChI=1S/C21H16FN3O3/c1-28-20-9-13(3-7-19(20)27)12-2-6-17-15(8-12)21(24-11-23-17)25-18-10-14(26)4-5-16(18)22/h2-11,26-27H,1H3,(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 16.1n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127086
PNG
(US8785459, 161)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3ccc(F)c(O)c3)c2c1
Show InChI InChI=1S/C21H16FN3O3/c1-28-20-9-13(3-7-18(20)26)12-2-6-17-15(8-12)21(24-11-23-17)25-14-4-5-16(22)19(27)10-14/h2-11,26-27H,1H3,(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 16.9n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127026
PNG
(US8785459, 101)
Show SMILES COc1cc(ccc1O)-c1ccc2nccc(Nc3cc(O)ccc3F)c2c1
Show InChI InChI=1S/C22H17FN2O3/c1-28-22-11-14(3-7-21(22)27)13-2-6-18-16(10-13)19(8-9-24-18)25-20-12-15(26)4-5-17(20)23/h2-12,26-27H,1H3,(H,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 18.1n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127085
PNG
(US8785459, 160)
Show SMILES Oc1cc(Nc2ncnc3ccc(cc23)-c2ccc(Cl)cc2)c(F)cc1F
Show InChI InChI=1S/C20H12ClF2N3O/c21-13-4-1-11(2-5-13)12-3-6-17-14(7-12)20(25-10-24-17)26-18-9-19(27)16(23)8-15(18)22/h1-10,27H,(H,24,25,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 19n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127084
PNG
(US8785459, 159)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(Cl)cc3F)c2c1
Show InChI InChI=1S/C21H15ClFN3O3/c1-29-20-7-12(3-5-18(20)27)11-2-4-16-13(6-11)21(25-10-24-16)26-17-9-19(28)14(22)8-15(17)23/h2-10,27-28H,1H3,(H,24,25,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 19.7n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127026
PNG
(US8785459, 101)
Show SMILES COc1cc(ccc1O)-c1ccc2nccc(Nc3cc(O)ccc3F)c2c1
Show InChI InChI=1S/C22H17FN2O3/c1-28-22-11-14(3-7-21(22)27)13-2-6-18-16(10-13)19(8-9-24-18)25-20-12-15(26)4-5-17(20)23/h2-12,26-27H,1H3,(H,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 20.9n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127025
PNG
(US8785459, 100)
Show SMILES COc1cc(ccc1O)-c1ccc2nccc(Nc3cccc(O)c3)c2c1
Show InChI InChI=1S/C22H18N2O3/c1-27-22-12-15(6-8-21(22)26)14-5-7-19-18(11-14)20(9-10-23-19)24-16-3-2-4-17(25)13-16/h2-13,25-26H,1H3,(H,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 21n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127025
PNG
(US8785459, 100)
Show SMILES COc1cc(ccc1O)-c1ccc2nccc(Nc3cccc(O)c3)c2c1
Show InChI InChI=1S/C22H18N2O3/c1-27-22-12-15(6-8-21(22)26)14-5-7-19-18(11-14)20(9-10-23-19)24-16-3-2-4-17(25)13-16/h2-13,25-26H,1H3,(H,23,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 23n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126983
PNG
(US8785459, 58)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)ccc3F)c2c1
Show InChI InChI=1S/C21H16FN3O3/c1-28-20-9-13(3-7-19(20)27)12-2-6-17-15(8-12)21(24-11-23-17)25-18-10-14(26)4-5-16(18)22/h2-11,26-27H,1H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 23.2n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127086
PNG
(US8785459, 161)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3ccc(F)c(O)c3)c2c1
Show InChI InChI=1S/C21H16FN3O3/c1-28-20-9-13(3-7-18(20)26)12-2-6-17-15(8-12)21(24-11-23-17)25-14-4-5-16(22)19(27)10-14/h2-11,26-27H,1H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 23.4n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127082
PNG
(US8785459, 157)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3ccc(Cl)c(O)c3)c2c1
Show InChI InChI=1S/C21H16ClN3O3/c1-28-20-9-13(3-7-18(20)26)12-2-6-17-15(8-12)21(24-11-23-17)25-14-4-5-16(22)19(27)10-14/h2-11,26-27H,1H3,(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 26.8n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126988
PNG
(US8785459, 63)
Show SMILES Oc1cccc(Nc2ncnc3ccc(cc23)-c2cccc(O)c2)c1
Show InChI InChI=1S/C20H15N3O2/c24-16-5-1-3-13(9-16)14-7-8-19-18(10-14)20(22-12-21-19)23-15-4-2-6-17(25)11-15/h1-12,24-25H,(H,21,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 27.7n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126933
PNG
(US8785459, 8)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1
Show InChI InChI=1S/C21H17N3O3/c1-27-20-10-14(6-8-19(20)26)13-5-7-18-17(9-13)21(23-12-22-18)24-15-3-2-4-16(25)11-15/h2-12,25-26H,1H3,(H,22,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 30.2n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126987
PNG
(US8785459, 62)
Show SMILES Oc1ccc(cc1)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1
Show InChI InChI=1S/C20H15N3O2/c24-16-7-4-13(5-8-16)14-6-9-19-18(10-14)20(22-12-21-19)23-15-2-1-3-17(25)11-15/h1-12,24-25H,(H,21,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 32.5n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM127083
PNG
(US8785459, 158)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(F)cc3F)c2c1
Show InChI InChI=1S/C21H15F2N3O3/c1-29-20-7-12(3-5-18(20)27)11-2-4-16-13(6-11)21(25-10-24-16)26-17-9-19(28)15(23)8-14(17)22/h2-10,27-28H,1H3,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 36.3n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126984
PNG
(US8785459, 59)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)ccc3Cl)c2c1
Show InChI InChI=1S/C21H16ClN3O3/c1-28-20-9-13(3-7-19(20)27)12-2-6-17-15(8-12)21(24-11-23-17)25-18-10-14(26)4-5-16(18)22/h2-11,26-27H,1H3,(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 36.5n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126933
PNG
(US8785459, 8)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1
Show InChI InChI=1S/C21H17N3O3/c1-27-20-10-14(6-8-19(20)26)13-5-7-18-17(9-13)21(23-12-22-18)24-15-3-2-4-16(25)11-15/h2-12,25-26H,1H3,(H,22,23,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 37.4n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127082
PNG
(US8785459, 157)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3ccc(Cl)c(O)c3)c2c1
Show InChI InChI=1S/C21H16ClN3O3/c1-28-20-9-13(3-7-18(20)26)12-2-6-17-15(8-12)21(24-11-23-17)25-14-4-5-16(22)19(27)10-14/h2-11,26-27H,1H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 37.5n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126985
PNG
(US8785459, 60)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cccc(O)c3Cl)c2c1
Show InChI InChI=1S/C21H16ClN3O3/c1-28-19-10-13(6-8-17(19)26)12-5-7-15-14(9-12)21(24-11-23-15)25-16-3-2-4-18(27)20(16)22/h2-11,26-27H,1H3,(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 39n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126986
PNG
(US8785459, 61)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(Cl)cc3Cl)c2c1
Show InChI InChI=1S/C21H15Cl2N3O3/c1-29-20-7-12(3-5-18(20)27)11-2-4-16-13(6-11)21(25-10-24-16)26-17-9-19(28)15(23)8-14(17)22/h2-10,27-28H,1H3,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 40.1n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126968
PNG
(US8785459, 43)
Show SMILES COc1cc(ccc1O)-c1cc2c(Nc3cc(O)ccc3Cl)ncnc2cc1OC
Show InChI InChI=1S/C22H18ClN3O4/c1-29-20-10-17-15(9-14(20)12-3-6-19(28)21(7-12)30-2)22(25-11-24-17)26-18-8-13(27)4-5-16(18)23/h3-11,27-28H,1-2H3,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 40.4n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126968
PNG
(US8785459, 43)
Show SMILES COc1cc(ccc1O)-c1cc2c(Nc3cc(O)ccc3Cl)ncnc2cc1OC
Show InChI InChI=1S/C22H18ClN3O4/c1-29-20-10-17-15(9-14(20)12-3-6-19(28)21(7-12)30-2)22(25-11-24-17)26-18-8-13(27)4-5-16(18)23/h3-11,27-28H,1-2H3,(H,24,25,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 47.3n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126988
PNG
(US8785459, 63)
Show SMILES Oc1cccc(Nc2ncnc3ccc(cc23)-c2cccc(O)c2)c1
Show InChI InChI=1S/C20H15N3O2/c24-16-5-1-3-13(9-16)14-7-8-19-18(10-14)20(22-12-21-19)23-15-4-2-6-17(25)11-15/h1-12,24-25H,(H,21,22,23)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 51.7n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126974
PNG
(US8785459, 49)
Show SMILES COc1cc2ncnc(Nc3cccc(O)c3)c2cc1-c1ccc(O)cc1
Show InChI InChI=1S/C21H17N3O3/c1-27-20-11-19-18(10-17(20)13-5-7-15(25)8-6-13)21(23-12-22-19)24-14-3-2-4-16(26)9-14/h2-12,25-26H,1H3,(H,22,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 55.3n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126993
PNG
(US8785459, 68)
Show SMILES COc1cc2ncnc(Nc3cccc(O)c3)c2cc1-c1ccc(N)cc1
Show InChI InChI=1S/C21H18N4O2/c1-27-20-11-19-18(10-17(20)13-5-7-14(22)8-6-13)21(24-12-23-19)25-15-3-2-4-16(26)9-15/h2-12,26H,22H2,1H3,(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 55.8n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126985
PNG
(US8785459, 60)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cccc(O)c3Cl)c2c1
Show InChI InChI=1S/C21H16ClN3O3/c1-28-19-10-13(6-8-17(19)26)12-5-7-15-14(9-12)21(24-11-23-15)25-16-3-2-4-18(27)20(16)22/h2-11,26-27H,1H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 56.5n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127081
PNG
(US8785459, 156)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(C)cc3F)c2c1
Show InChI InChI=1S/C22H18FN3O3/c1-12-7-16(23)18(10-20(12)28)26-22-15-8-13(3-5-17(15)24-11-25-22)14-4-6-19(27)21(9-14)29-2/h3-11,27-28H,1-2H3,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 57.3n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126986
PNG
(US8785459, 61)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(Cl)cc3Cl)c2c1
Show InChI InChI=1S/C21H15Cl2N3O3/c1-29-20-7-12(3-5-18(20)27)11-2-4-16-13(6-11)21(25-10-24-16)26-17-9-19(28)15(23)8-14(17)22/h2-10,27-28H,1H3,(H,24,25,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 59.9n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127079
PNG
(US8785459, 154)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)ccc3C)c2c1
Show InChI InChI=1S/C22H19N3O3/c1-13-3-6-16(26)11-19(13)25-22-17-9-14(4-7-18(17)23-12-24-22)15-5-8-20(27)21(10-15)28-2/h3-12,26-27H,1-2H3,(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 60n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126987
PNG
(US8785459, 62)
Show SMILES Oc1ccc(cc1)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1
Show InChI InChI=1S/C20H15N3O2/c24-16-7-4-13(5-8-16)14-6-9-19-18(10-14)20(22-12-21-19)23-15-2-1-3-17(25)11-15/h1-12,24-25H,(H,21,22,23)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 60.1n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126989
PNG
(US8785459, 64)
Show SMILES COc1ccc(cc1)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1
Show InChI InChI=1S/C21H17N3O2/c1-26-18-8-5-14(6-9-18)15-7-10-20-19(11-15)21(23-13-22-20)24-16-3-2-4-17(25)12-16/h2-13,25H,1H3,(H,22,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 62.4n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126984
PNG
(US8785459, 59)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)ccc3Cl)c2c1
Show InChI InChI=1S/C21H16ClN3O3/c1-28-20-9-13(3-7-19(20)27)12-2-6-17-15(8-12)21(24-11-23-17)25-18-10-14(26)4-5-16(18)22/h2-11,26-27H,1H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 64.7n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM127084
PNG
(US8785459, 159)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(Cl)cc3F)c2c1
Show InChI InChI=1S/C21H15ClFN3O3/c1-29-20-7-12(3-5-18(20)27)11-2-4-16-13(6-11)21(25-10-24-16)26-17-9-19(28)14(22)8-15(17)23/h2-10,27-28H,1H3,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 69.2n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127079
PNG
(US8785459, 154)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)ccc3C)c2c1
Show InChI InChI=1S/C22H19N3O3/c1-13-3-6-16(26)11-19(13)25-22-17-9-14(4-7-18(17)23-12-24-22)15-5-8-20(27)21(10-15)28-2/h3-12,26-27H,1-2H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 70.9n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126974
PNG
(US8785459, 49)
Show SMILES COc1cc2ncnc(Nc3cccc(O)c3)c2cc1-c1ccc(O)cc1
Show InChI InChI=1S/C21H17N3O3/c1-27-20-11-19-18(10-17(20)13-5-7-15(25)8-6-13)21(23-12-22-19)24-14-3-2-4-16(26)9-14/h2-12,25-26H,1H3,(H,22,23,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 71.6n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126997
PNG
(US8785459, 72)
Show SMILES CS(=O)(=O)Nc1cccc(c1)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1
Show InChI InChI=1S/C21H18N4O3S/c1-29(27,28)25-17-6-2-4-14(10-17)15-8-9-20-19(11-15)21(23-13-22-20)24-16-5-3-7-18(26)12-16/h2-13,25-26H,1H3,(H,22,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 73.8n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127023
PNG
(US8785459, 98)
Show SMILES COc1ccc(cc1C=O)-c1ccc2ncnc(Nc3cccc4[nH]ncc34)c2c1
Show InChI InChI=1S/C23H17N5O2/c1-30-22-8-6-14(9-16(22)12-29)15-5-7-19-17(10-15)23(25-13-24-19)27-20-3-2-4-21-18(20)11-26-28-21/h2-13H,1H3,(H,26,28)(H,24,25,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 73.9n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126993
PNG
(US8785459, 68)
Show SMILES COc1cc2ncnc(Nc3cccc(O)c3)c2cc1-c1ccc(N)cc1
Show InChI InChI=1S/C21H18N4O2/c1-27-20-11-19-18(10-17(20)13-5-7-14(22)8-6-13)21(24-12-23-19)25-15-3-2-4-16(26)9-15/h2-12,26H,22H2,1H3,(H,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 76.6n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM127081
PNG
(US8785459, 156)
Show SMILES COc1cc(ccc1O)-c1ccc2ncnc(Nc3cc(O)c(C)cc3F)c2c1
Show InChI InChI=1S/C22H18FN3O3/c1-12-7-16(23)18(10-20(12)28)26-22-15-8-13(3-5-17(15)24-11-25-22)14-4-6-19(27)21(9-14)29-2/h3-11,27-28H,1-2H3,(H,24,25,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 81.7n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM127036
PNG
(US8785459, 111)
Show SMILES COc1cccc(-c2ccc3nccc(Nc4cccc5[nH]ncc45)c3c2)c1F
Show InChI InChI=1S/C23H17FN4O/c1-29-22-7-2-4-15(23(22)24)14-8-9-18-16(12-14)20(10-11-25-18)27-19-5-3-6-21-17(19)13-26-28-21/h2-13H,1H3,(H,25,27)(H,26,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 83.4n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))		BDBM126956
PNG
(US8785459, 31)
Show SMILES COc1cc(ccc1O)-c1cc2c(Nc3cccc(O)c3)ncnc2cc1OC
Show InChI InChI=1S/C22H19N3O4/c1-28-20-11-18-17(10-16(20)13-6-7-19(27)21(8-13)29-2)22(24-12-23-18)25-14-4-3-5-15(26)9-14/h3-12,26-27H,1-2H3,(H,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 87n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf [V600E]


(Homo sapiens (Human))		BDBM126997
PNG
(US8785459, 72)
Show SMILES CS(=O)(=O)Nc1cccc(c1)-c1ccc2ncnc(Nc3cccc(O)c3)c2c1
Show InChI InChI=1S/C21H18N4O3S/c1-29(27,28)25-17-6-2-4-14(10-17)15-8-9-20-19(11-15)21(23-13-22-20)24-16-5-3-7-18(26)12-16/h2-13,25-26H,1H3,(H,22,23,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 90n/an/an/an/an/an/a



Development Center for Biotechnology

US Patent


Assay Description
Inhibition of kinase activity by test compound disclosed herein was estimated by quantifying the amount of [33P] incorporation of substrate in the pr...

US Patent US8785459 (2014)


BindingDB Entry DOI: 10.7270/Q2M907BP
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 386 total )  |  Next  |  Last  >>
* indicates data uncertainty>20%