Found 30 hits Enz. Inhib. hit(s) with all data for entry = 50047440 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167880
(CHEMBL3800043)Show SMILES CC(C)c1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C25H26N4O2/c1-16(2)18-5-3-6-19(13-18)25(31)28-21-8-4-7-20(14-21)27-22-11-12-26-23(15-22)29-24(30)17-9-10-17/h3-8,11-17H,9-10H2,1-2H3,(H,28,31)(H2,26,27,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM99471
(US8497274, 32)Show SMILES Fc1ccc(Oc2ccc3nc(NC(=O)C4CC4)sc3c2C#N)cc1NC(=O)Cc1cccc(c1)C(F)(F)F Show InChI InChI=1S/C27H18F4N4O3S/c28-19-7-6-17(12-21(19)33-23(36)11-14-2-1-3-16(10-14)27(29,30)31)38-22-9-8-20-24(18(22)13-32)39-26(34-20)35-25(37)15-4-5-15/h1-3,6-10,12,15H,4-5,11H2,(H,33,36)(H,34,35,37) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167879
(CHEMBL3797670)Show SMILES CC(C)(C)c1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C26H28N4O2/c1-26(2,3)19-7-4-6-18(14-19)25(32)29-21-9-5-8-20(15-21)28-22-12-13-27-23(16-22)30-24(31)17-10-11-17/h4-9,12-17H,10-11H2,1-3H3,(H,29,32)(H2,27,28,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167878
(CHEMBL3798225)Show SMILES O=C(Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1)C1CC1 Show InChI InChI=1S/C25H24N4O2/c30-24(17-9-10-17)29-23-15-22(11-12-26-23)27-20-5-2-6-21(14-20)28-25(31)19-4-1-3-18(13-19)16-7-8-16/h1-6,11-17H,7-10H2,(H,28,31)(H2,26,27,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167877
(CHEMBL3798081)Show SMILES CC(C)(C#N)c1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C26H25N5O2/c1-26(2,16-27)19-6-3-5-18(13-19)25(33)30-21-8-4-7-20(14-21)29-22-11-12-28-23(15-22)31-24(32)17-9-10-17/h3-8,11-15,17H,9-10H2,1-2H3,(H,30,33)(H2,28,29,31,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167875
(CHEMBL3799934)Show SMILES CC(=O)Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1 Show InChI InChI=1S/C23H22N4O2/c1-15(28)25-22-14-21(10-11-24-22)26-19-6-3-7-20(13-19)27-23(29)18-5-2-4-17(12-18)16-8-9-16/h2-7,10-14,16H,8-9H2,1H3,(H,27,29)(H2,24,25,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50396483
(PLX-4032 | RG 7204 | Ro 5185426 | US10570155, Vemu...)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F Show InChI InChI=1S/C23H18ClF2N3O3S/c1-2-9-33(31,32)29-19-8-7-18(25)20(21(19)26)22(30)17-12-28-23-16(17)10-14(11-27-23)13-3-5-15(24)6-4-13/h3-8,10-12,29H,2,9H2,1H3,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | 59 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM99471
(US8497274, 32)Show SMILES Fc1ccc(Oc2ccc3nc(NC(=O)C4CC4)sc3c2C#N)cc1NC(=O)Cc1cccc(c1)C(F)(F)F Show InChI InChI=1S/C27H18F4N4O3S/c28-19-7-6-17(12-21(19)33-23(36)11-14-2-1-3-16(10-14)27(29,30)31)38-22-9-8-20-24(18(22)13-32)39-26(34-20)35-25(37)15-4-5-15/h1-3,6-10,12,15H,4-5,11H2,(H,33,36)(H,34,35,37) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | 77 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant wild type full length human GST-tagged B-Raf expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as s... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167876
(CHEMBL3800220)Show SMILES O=C(Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3(CC3)C#N)c2)ccn1)C1CC1 Show InChI InChI=1S/C26H23N5O2/c27-16-26(10-11-26)19-4-1-3-18(13-19)25(33)30-21-6-2-5-20(14-21)29-22-9-12-28-23(15-22)31-24(32)17-7-8-17/h1-6,9,12-15,17H,7-8,10-11H2,(H,30,33)(H2,28,29,31,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167888
(CHEMBL3798469)Show SMILES CCc1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C24H24N4O2/c1-2-16-5-3-6-18(13-16)24(30)27-20-8-4-7-19(14-20)26-21-11-12-25-22(15-21)28-23(29)17-9-10-17/h3-8,11-15,17H,2,9-10H2,1H3,(H,27,30)(H2,25,26,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50396483
(PLX-4032 | RG 7204 | Ro 5185426 | US10570155, Vemu...)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F Show InChI InChI=1S/C23H18ClF2N3O3S/c1-2-9-33(31,32)29-19-8-7-18(25)20(21(19)26)22(30)17-12-28-23-16(17)10-14(11-27-23)13-3-5-15(24)6-4-13/h3-8,10-12,29H,2,9H2,1H3,(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Similars
| DrugBank
PDB
Article
PubMed
| n/a | n/a | 119 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant wild type full length human GST-tagged B-Raf expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as s... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167886
(CHEMBL3797339)Show SMILES CCC(=O)Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1 Show InChI InChI=1S/C24H24N4O2/c1-2-23(29)28-22-15-21(11-12-25-22)26-19-7-4-8-20(14-19)27-24(30)18-6-3-5-17(13-18)16-9-10-16/h3-8,11-16H,2,9-10H2,1H3,(H,27,30)(H2,25,26,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 125 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167900
(CHEMBL3799171)Show SMILES FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C23H19F3N4O2/c24-23(25,26)16-4-1-3-15(11-16)22(32)29-18-6-2-5-17(12-18)28-19-9-10-27-20(13-19)30-21(31)14-7-8-14/h1-6,9-14H,7-8H2,(H,29,32)(H2,27,28,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 141 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167880
(CHEMBL3800043)Show SMILES CC(C)c1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C25H26N4O2/c1-16(2)18-5-3-6-19(13-18)25(31)28-21-8-4-7-20(14-21)27-22-11-12-26-23(15-22)29-24(30)17-9-10-17/h3-8,11-17H,9-10H2,1-2H3,(H,28,31)(H2,26,27,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 148 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant wild type full length human GST-tagged B-Raf expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as s... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167883
(CHEMBL3798661)Show SMILES O=C(Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1)C1CCC1 Show InChI InChI=1S/C26H26N4O2/c31-25(18-4-1-5-18)30-24-16-23(12-13-27-24)28-21-8-3-9-22(15-21)29-26(32)20-7-2-6-19(14-20)17-10-11-17/h2-3,6-9,12-18H,1,4-5,10-11H2,(H,29,32)(H2,27,28,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 182 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167879
(CHEMBL3797670)Show SMILES CC(C)(C)c1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C26H28N4O2/c1-26(2,3)19-7-4-6-18(14-19)25(32)29-21-9-5-8-20(15-21)28-22-12-13-27-23(16-22)30-24(31)17-10-11-17/h4-9,12-17H,10-11H2,1-3H3,(H,29,32)(H2,27,28,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant wild type full length human GST-tagged B-Raf expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as s... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167885
(CHEMBL3800288)Show SMILES CC(C)C(=O)Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1 Show InChI InChI=1S/C25H26N4O2/c1-16(2)24(30)29-23-15-22(11-12-26-23)27-20-7-4-8-21(14-20)28-25(31)19-6-3-5-18(13-19)17-9-10-17/h3-8,11-17H,9-10H2,1-2H3,(H,28,31)(H2,26,27,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 420 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167882
(CHEMBL3800517)Show SMILES O=C(Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1)C1CCCC1 Show InChI InChI=1S/C27H28N4O2/c32-26(19-5-1-2-6-19)31-25-17-24(13-14-28-25)29-22-9-4-10-23(16-22)30-27(33)21-8-3-7-20(15-21)18-11-12-18/h3-4,7-10,13-19H,1-2,5-6,11-12H2,(H,30,33)(H2,28,29,31,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 434 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167878
(CHEMBL3798225)Show SMILES O=C(Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1)C1CC1 Show InChI InChI=1S/C25H24N4O2/c30-24(17-9-10-17)29-23-15-22(11-12-26-23)27-20-5-2-6-21(14-20)28-25(31)19-4-1-3-18(13-19)16-7-8-16/h1-6,11-17H,7-10H2,(H,28,31)(H2,26,27,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 453 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant wild type full length human GST-tagged B-Raf expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as s... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167877
(CHEMBL3798081)Show SMILES CC(C)(C#N)c1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C26H25N5O2/c1-26(2,16-27)19-6-3-5-18(13-19)25(33)30-21-8-4-7-20(14-21)29-22-11-12-28-23(15-22)31-24(32)17-9-10-17/h3-8,11-15,17H,9-10H2,1-2H3,(H,30,33)(H2,28,29,31,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 476 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant wild type full length human GST-tagged B-Raf expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as s... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167881
(CHEMBL3797591)Show SMILES O=C(Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1)C1CCCCC1 Show InChI InChI=1S/C28H30N4O2/c33-27(20-6-2-1-3-7-20)32-26-18-25(14-15-29-26)30-23-10-5-11-24(17-23)31-28(34)22-9-4-8-21(16-22)19-12-13-19/h4-5,8-11,14-20H,1-3,6-7,12-13H2,(H,31,34)(H2,29,30,32,33) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 563 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167895
(CHEMBL3797868)Show SMILES Clc1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C22H19ClN4O2/c23-16-4-1-3-15(11-16)22(29)26-18-6-2-5-17(12-18)25-19-9-10-24-20(13-19)27-21(28)14-7-8-14/h1-6,9-14H,7-8H2,(H,26,29)(H2,24,25,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 785 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167884
(CHEMBL3799637)Show SMILES CC(C)(C)C(=O)Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1 Show InChI InChI=1S/C26H28N4O2/c1-26(2,3)25(32)30-23-16-22(12-13-27-23)28-20-8-5-9-21(15-20)29-24(31)19-7-4-6-18(14-19)17-10-11-17/h4-9,12-17H,10-11H2,1-3H3,(H,29,31)(H2,27,28,30,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.03E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167875
(CHEMBL3799934)Show SMILES CC(=O)Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3CC3)c2)ccn1 Show InChI InChI=1S/C23H22N4O2/c1-15(28)25-22-14-21(10-11-24-22)26-19-6-3-7-20(13-19)27-23(29)18-5-2-4-17(12-18)16-8-9-16/h2-7,10-14,16H,8-9H2,1H3,(H,27,29)(H2,24,25,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant wild type full length human GST-tagged B-Raf expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as s... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167889
(CHEMBL3800388)Show SMILES Cc1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C23H22N4O2/c1-15-4-2-5-17(12-15)23(29)26-19-7-3-6-18(13-19)25-20-10-11-24-21(14-20)27-22(28)16-8-9-16/h2-7,10-14,16H,8-9H2,1H3,(H,26,29)(H2,24,25,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.21E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167894
(CHEMBL3797953)Show SMILES [O-][N+](=O)c1cccc(c1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C22H19N5O4/c28-21(14-7-8-14)26-20-13-18(9-10-23-20)24-16-4-2-5-17(12-16)25-22(29)15-3-1-6-19(11-15)27(30)31/h1-6,9-14H,7-8H2,(H,25,29)(H2,23,24,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167876
(CHEMBL3800220)Show SMILES O=C(Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C3(CC3)C#N)c2)ccn1)C1CC1 Show InChI InChI=1S/C26H23N5O2/c27-16-26(10-11-26)19-4-1-3-18(13-19)25(33)30-21-6-2-5-20(14-21)29-22-9-12-28-23(15-22)31-24(32)17-7-8-17/h1-6,9,12-15,17H,7-8,10-11H2,(H,30,33)(H2,28,29,31,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.03E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant wild type full length human GST-tagged B-Raf expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as s... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167893
(CHEMBL3798792)Show SMILES O=C(Nc1cc(Nc2cccc(NC(=O)c3cccc(c3)C#N)c2)ccn1)C1CC1 Show InChI InChI=1S/C23H19N5O2/c24-14-15-3-1-4-17(11-15)23(30)27-19-6-2-5-18(12-19)26-20-9-10-25-21(13-20)28-22(29)16-7-8-16/h1-6,9-13,16H,7-8H2,(H,27,30)(H2,25,26,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.53E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167897
(CHEMBL3798151)Show SMILES FC(F)(F)c1ccc(cc1)C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C23H19F3N4O2/c24-23(25,26)16-8-6-15(7-9-16)21(31)29-18-3-1-2-17(12-18)28-19-10-11-27-20(13-19)30-22(32)14-4-5-14/h1-3,6-14H,4-5H2,(H,29,31)(H2,27,28,30,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50167899
(CHEMBL3799344)Show SMILES FC(F)(F)c1ccccc1C(=O)Nc1cccc(Nc2ccnc(NC(=O)C3CC3)c2)c1 Show InChI InChI=1S/C23H19F3N4O2/c24-23(25,26)19-7-2-1-6-18(19)22(32)29-16-5-3-4-15(12-16)28-17-10-11-27-20(13-17)30-21(31)14-8-9-14/h1-7,10-14H,8-9H2,(H,29,32)(H2,27,28,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Jilin University
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human N-terminal GST-tagged B-Raf V600E mutant expressed in baculovirus expression system using Z'-LYTE Ser/Thr3 peptide as... |
Bioorg Med Chem Lett 26: 2760-2763 (2016)
Article DOI: 10.1016/j.bmcl.2016.04.076
BindingDB Entry DOI: 10.7270/Q2J67JTP |
More data for this
Ligand-Target Pair | |
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