Found 48 hits of Enzyme Inhibition Constant Data 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)) | BDBM50484234
(CHEMBL1822067)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]nc(OC)c3c2)c1F Show InChI InChI=1S/C17H17F2N5O4S/c1-3-6-29(26,27)24-12-5-4-11(18)13(14(12)19)16(25)21-9-7-10-15(20-8-9)22-23-17(10)28-2/h4-5,7-8,24H,3,6H2,1-2H3,(H,21,25)(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485103
(CHEMBL2030242)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2ccccc2)c1F Show InChI InChI=1S/C22H19F2N5O3S/c1-2-10-33(31,32)28-17-9-8-16(23)20(21(17)24)22(30)26-15-12-25-19-11-18(27-29(19)13-15)14-6-4-3-5-7-14/h3-9,11-13,28H,2,10H2,1H3,(H,26,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485096
(CHEMBL2030244)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2ccc(F)cc2)c1F Show InChI InChI=1S/C22H18F3N5O3S/c1-2-9-34(32,33)29-17-8-7-16(24)20(21(17)25)22(31)27-15-11-26-19-10-18(28-30(19)12-15)13-3-5-14(23)6-4-13/h3-8,10-12,29H,2,9H2,1H3,(H,27,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485097
(CHEMBL2030245)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2cccnc2)c1F Show InChI InChI=1S/C21H18F2N6O3S/c1-2-8-33(31,32)28-16-6-5-15(22)19(20(16)23)21(30)26-14-11-25-18-9-17(27-29(18)12-14)13-4-3-7-24-10-13/h3-7,9-12,28H,2,8H2,1H3,(H,26,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485108
(CHEMBL2030246)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2cnn(C)c2)c1F Show InChI InChI=1S/C20H19F2N7O3S/c1-3-6-33(31,32)27-15-5-4-14(21)18(19(15)22)20(30)25-13-9-23-17-7-16(26-29(17)11-13)12-8-24-28(2)10-12/h4-5,7-11,27H,3,6H2,1-2H3,(H,25,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485103
(CHEMBL2030242)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2ccccc2)c1F Show InChI InChI=1S/C22H19F2N5O3S/c1-2-10-33(31,32)28-17-9-8-16(23)20(21(17)24)22(30)26-15-12-25-19-11-18(27-29(19)13-15)14-6-4-3-5-7-14/h3-9,11-13,28H,2,10H2,1H3,(H,26,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485104
(CHEMBL2030243)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2cccc(F)c2)c1F Show InChI InChI=1S/C22H18F3N5O3S/c1-2-8-34(32,33)29-17-7-6-16(24)20(21(17)25)22(31)27-15-11-26-19-10-18(28-30(19)12-15)13-4-3-5-14(23)9-13/h3-7,9-12,29H,2,8H2,1H3,(H,27,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50484234
(CHEMBL1822067)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3[nH]nc(OC)c3c2)c1F Show InChI InChI=1S/C17H17F2N5O4S/c1-3-6-29(26,27)24-12-5-4-11(18)13(14(12)19)16(25)21-9-7-10-15(20-8-9)22-23-17(10)28-2/h4-5,7-8,24H,3,6H2,1-2H3,(H,21,25)(H,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485097
(CHEMBL2030245)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2cccnc2)c1F Show InChI InChI=1S/C21H18F2N6O3S/c1-2-8-33(31,32)28-16-6-5-15(22)19(20(16)23)21(30)26-14-11-25-18-9-17(27-29(18)12-14)13-4-3-7-24-10-13/h3-7,9-12,28H,2,8H2,1H3,(H,26,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 27 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485102
(CHEMBL2030238)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(OC)nn3c2)c1F Show InChI InChI=1S/C17H17F2N5O4S/c1-3-6-29(26,27)23-12-5-4-11(18)15(16(12)19)17(25)21-10-8-20-13-7-14(28-2)22-24(13)9-10/h4-5,7-9,23H,3,6H2,1-2H3,(H,21,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485108
(CHEMBL2030246)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2cnn(C)c2)c1F Show InChI InChI=1S/C20H19F2N7O3S/c1-3-6-33(31,32)27-15-5-4-14(21)18(19(15)22)20(30)25-13-9-23-17-7-16(26-29(17)11-13)12-8-24-28(2)10-12/h4-5,7-11,27H,3,6H2,1-2H3,(H,25,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485096
(CHEMBL2030244)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2ccc(F)cc2)c1F Show InChI InChI=1S/C22H18F3N5O3S/c1-2-9-34(32,33)29-17-8-7-16(24)20(21(17)25)22(31)27-15-11-26-19-10-18(28-30(19)12-15)13-3-5-14(23)6-4-13/h3-8,10-12,29H,2,9H2,1H3,(H,27,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 54 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485104
(CHEMBL2030243)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)-c2cccc(F)c2)c1F Show InChI InChI=1S/C22H18F3N5O3S/c1-2-8-34(32,33)29-17-7-6-16(24)20(21(17)25)22(31)27-15-11-26-19-10-18(28-30(19)12-15)13-4-3-5-14(23)9-13/h3-7,9-12,29H,2,8H2,1H3,(H,27,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485095
(CHEMBL2030241)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(OCCOC)nn3c2)c1F Show InChI InChI=1S/C19H21F2N5O5S/c1-3-8-32(28,29)25-14-5-4-13(20)17(18(14)21)19(27)23-12-10-22-15-9-16(24-26(15)11-12)31-7-6-30-2/h4-5,9-11,25H,3,6-8H2,1-2H3,(H,23,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485102
(CHEMBL2030238)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(OC)nn3c2)c1F Show InChI InChI=1S/C17H17F2N5O4S/c1-3-6-29(26,27)23-12-5-4-11(18)15(16(12)19)17(25)21-10-8-20-13-7-14(28-2)22-24(13)9-10/h4-5,7-9,23H,3,6H2,1-2H3,(H,21,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 68 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485094
(CHEMBL2030239)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(OCC)nn3c2)c1F Show InChI InChI=1S/C18H19F2N5O4S/c1-3-7-30(27,28)24-13-6-5-12(19)16(17(13)20)18(26)22-11-9-21-14-8-15(29-4-2)23-25(14)10-11/h5-6,8-10,24H,3-4,7H2,1-2H3,(H,22,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 83 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485091
(CHEMBL2030230)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(CC)nn3c2)c1F Show InChI InChI=1S/C18H19F2N5O3S/c1-3-7-29(27,28)24-14-6-5-13(19)16(17(14)20)18(26)22-12-9-21-15-8-11(4-2)23-25(15)10-12/h5-6,8-10,24H,3-4,7H2,1-2H3,(H,22,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 105 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485095
(CHEMBL2030241)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(OCCOC)nn3c2)c1F Show InChI InChI=1S/C19H21F2N5O5S/c1-3-8-32(28,29)25-14-5-4-13(20)17(18(14)21)19(27)23-12-10-22-15-9-16(24-26(15)11-12)31-7-6-30-2/h4-5,9-11,25H,3,6-8H2,1-2H3,(H,23,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485092
(CHEMBL2030231)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)C2CC2)c1F Show InChI InChI=1S/C19H19F2N5O3S/c1-2-7-30(28,29)25-14-6-5-13(20)17(18(14)21)19(27)23-12-9-22-16-8-15(11-3-4-11)24-26(16)10-12/h5-6,8-11,25H,2-4,7H2,1H3,(H,23,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 124 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485087
(CHEMBL2030233)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)C(F)(F)F)c1F Show InChI InChI=1S/C17H14F5N5O3S/c1-2-5-31(29,30)26-11-4-3-10(18)14(15(11)19)16(28)24-9-7-23-13-6-12(17(20,21)22)25-27(13)8-9/h3-4,6-8,26H,2,5H2,1H3,(H,24,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 126 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485099
(CHEMBL2030232)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)C2CCCC2)c1F Show InChI InChI=1S/C21H23F2N5O3S/c1-2-9-32(30,31)27-16-8-7-15(22)19(20(16)23)21(29)25-14-11-24-18-10-17(26-28(18)12-14)13-5-3-4-6-13/h7-8,10-13,27H,2-6,9H2,1H3,(H,25,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 128 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485100
(CHEMBL2030234)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(NC)nn3c2)c1F Show InChI InChI=1S/C17H18F2N6O3S/c1-3-6-29(27,28)24-12-5-4-11(18)15(16(12)19)17(26)22-10-8-21-14-7-13(20-2)23-25(14)9-10/h4-5,7-9,24H,3,6H2,1-2H3,(H,20,23)(H,22,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 129 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485105
(CHEMBL2030229)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(C)nn3c2)c1F Show InChI InChI=1S/C17H17F2N5O3S/c1-3-6-28(26,27)23-13-5-4-12(18)15(16(13)19)17(25)21-11-8-20-14-7-10(2)22-24(14)9-11/h4-5,7-9,23H,3,6H2,1-2H3,(H,21,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 131 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485106
(CHEMBL2030240)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(OC(C)C)nn3c2)c1F Show InChI InChI=1S/C19H21F2N5O4S/c1-4-7-31(28,29)25-14-6-5-13(20)17(18(14)21)19(27)23-12-9-22-15-8-16(30-11(2)3)24-26(15)10-12/h5-6,8-11,25H,4,7H2,1-3H3,(H,23,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 149 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485086
(CHEMBL2030237)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)N2CCOCC2)c1F Show InChI InChI=1S/C20H22F2N6O4S/c1-2-9-33(30,31)26-15-4-3-14(21)18(19(15)22)20(29)24-13-11-23-16-10-17(25-28(16)12-13)27-5-7-32-8-6-27/h3-4,10-12,26H,2,5-9H2,1H3,(H,24,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 174 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485101
(CHEMBL2030235)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(NC(C)C)nn3c2)c1F Show InChI InChI=1S/C19H22F2N6O3S/c1-4-7-31(29,30)26-14-6-5-13(20)17(18(14)21)19(28)24-12-9-22-16-8-15(23-11(2)3)25-27(16)10-12/h5-6,8-11,26H,4,7H2,1-3H3,(H,23,25)(H,24,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485094
(CHEMBL2030239)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(OCC)nn3c2)c1F Show InChI InChI=1S/C18H19F2N5O4S/c1-3-7-30(27,28)24-13-6-5-12(19)16(17(13)20)18(26)22-11-9-21-14-8-15(29-4-2)23-25(14)10-11/h5-6,8-10,24H,3-4,7H2,1-2H3,(H,22,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 205 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485091
(CHEMBL2030230)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(CC)nn3c2)c1F Show InChI InChI=1S/C18H19F2N5O3S/c1-3-7-29(27,28)24-14-6-5-13(19)16(17(14)20)18(26)22-12-9-21-15-8-11(4-2)23-25(15)10-12/h5-6,8-10,24H,3-4,7H2,1-2H3,(H,22,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 228 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485090
(CHEMBL2030228)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3ccnn3c2)c1F Show InChI InChI=1S/C16H15F2N5O3S/c1-2-7-27(25,26)22-12-4-3-11(17)14(15(12)18)16(24)21-10-8-19-13-5-6-20-23(13)9-10/h3-6,8-9,22H,2,7H2,1H3,(H,21,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 247 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485105
(CHEMBL2030229)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(C)nn3c2)c1F Show InChI InChI=1S/C17H17F2N5O3S/c1-3-6-28(26,27)23-13-5-4-12(18)15(16(13)19)17(25)21-11-8-20-14-7-10(2)22-24(14)9-11/h4-5,7-9,23H,3,6H2,1-2H3,(H,21,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 248 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485092
(CHEMBL2030231)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)C2CC2)c1F Show InChI InChI=1S/C19H19F2N5O3S/c1-2-7-30(28,29)25-14-6-5-13(20)17(18(14)21)19(27)23-12-9-22-16-8-15(11-3-4-11)24-26(16)10-12/h5-6,8-11,25H,2-4,7H2,1H3,(H,23,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 299 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485086
(CHEMBL2030237)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)N2CCOCC2)c1F Show InChI InChI=1S/C20H22F2N6O4S/c1-2-9-33(30,31)26-15-4-3-14(21)18(19(15)22)20(29)24-13-11-23-16-10-17(25-28(16)12-13)27-5-7-32-8-6-27/h3-4,10-12,26H,2,5-9H2,1H3,(H,24,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 315 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485093
(CHEMBL2030236)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)N2CCCC2)c1F Show InChI InChI=1S/C20H22F2N6O3S/c1-2-9-32(30,31)26-15-6-5-14(21)18(19(15)22)20(29)24-13-11-23-16-10-17(25-28(16)12-13)27-7-3-4-8-27/h5-6,10-12,26H,2-4,7-9H2,1H3,(H,24,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 367 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485087
(CHEMBL2030233)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)C(F)(F)F)c1F Show InChI InChI=1S/C17H14F5N5O3S/c1-2-5-31(29,30)26-11-4-3-10(18)14(15(11)19)16(28)24-9-7-23-13-6-12(17(20,21)22)25-27(13)8-9/h3-4,6-8,26H,2,5H2,1H3,(H,24,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 374 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485100
(CHEMBL2030234)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(NC)nn3c2)c1F Show InChI InChI=1S/C17H18F2N6O3S/c1-3-6-29(27,28)24-12-5-4-11(18)15(16(12)19)17(26)22-10-8-21-14-7-13(20-2)23-25(14)9-10/h4-5,7-9,24H,3,6H2,1-2H3,(H,20,23)(H,22,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 382 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485101
(CHEMBL2030235)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(NC(C)C)nn3c2)c1F Show InChI InChI=1S/C19H22F2N6O3S/c1-4-7-31(29,30)26-14-6-5-13(20)17(18(14)21)19(28)24-12-9-22-16-8-15(23-11(2)3)25-27(16)10-12/h5-6,8-11,26H,4,7H2,1-3H3,(H,23,25)(H,24,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 395 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485089
(CHEMBL2030227)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc[nH]c3c2)c1F Show InChI InChI=1S/C17H16F2N4O3S/c1-2-7-27(25,26)23-13-4-3-11(18)15(16(13)19)17(24)22-10-8-14-12(21-9-10)5-6-20-14/h3-6,8-9,20,23H,2,7H2,1H3,(H,22,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 407 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485099
(CHEMBL2030232)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)C2CCCC2)c1F Show InChI InChI=1S/C21H23F2N5O3S/c1-2-9-32(30,31)27-16-8-7-15(22)19(20(16)23)21(29)25-14-11-24-18-10-17(26-28(18)12-14)13-5-3-4-6-13/h7-8,10-13,27H,2-6,9H2,1H3,(H,25,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 448 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485106
(CHEMBL2030240)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(OC(C)C)nn3c2)c1F Show InChI InChI=1S/C19H21F2N5O4S/c1-4-7-31(28,29)25-14-6-5-13(20)17(18(14)21)19(27)23-12-9-22-15-8-16(30-11(2)3)24-26(15)10-12/h5-6,8-11,25H,4,7H2,1-3H3,(H,23,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 449 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485098
(CHEMBL2030224)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3ccccc3c2)c1F Show InChI InChI=1S/C19H17F2N3O3S/c1-2-9-28(26,27)24-16-8-7-14(20)17(18(16)21)19(25)23-13-10-12-5-3-4-6-15(12)22-11-13/h3-8,10-11,24H,2,9H2,1H3,(H,23,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 464 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485090
(CHEMBL2030228)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3ccnn3c2)c1F Show InChI InChI=1S/C16H15F2N5O3S/c1-2-7-27(25,26)22-12-4-3-11(17)14(15(12)18)16(24)21-10-8-19-13-5-6-20-23(13)9-10/h3-6,8-9,22H,2,7H2,1H3,(H,21,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 488 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485093
(CHEMBL2030236)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc(nn3c2)N2CCCC2)c1F Show InChI InChI=1S/C20H22F2N6O3S/c1-2-9-32(30,31)26-15-6-5-14(21)18(19(15)22)20(29)24-13-11-23-16-10-17(25-28(16)12-13)27-7-3-4-8-27/h5-6,10-12,26H,2-4,7-9H2,1H3,(H,24,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 664 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485098
(CHEMBL2030224)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3ccccc3c2)c1F Show InChI InChI=1S/C19H17F2N3O3S/c1-2-9-28(26,27)24-16-8-7-14(20)17(18(16)21)19(25)23-13-10-12-5-3-4-6-15(12)22-11-13/h3-8,10-11,24H,2,9H2,1H3,(H,23,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.38E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485089
(CHEMBL2030227)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3cc[nH]c3c2)c1F Show InChI InChI=1S/C17H16F2N4O3S/c1-2-7-27(25,26)23-13-4-3-11(18)15(16(13)19)17(24)22-10-8-14-12(21-9-10)5-6-20-14/h3-6,8-9,20,23H,2,7H2,1H3,(H,22,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50484701
(CHEMBL1945018)Show InChI InChI=1S/C15H15F2N3O3S/c1-2-8-24(22,23)20-12-6-5-11(16)13(14(12)17)15(21)19-10-4-3-7-18-9-10/h3-7,9,20H,2,8H2,1H3,(H,19,21) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50484701
(CHEMBL1945018)Show InChI InChI=1S/C15H15F2N3O3S/c1-2-8-24(22,23)20-12-6-5-11(16)13(14(12)17)15(21)19-10-4-3-7-18-9-10/h3-7,9,20H,2,8H2,1H3,(H,19,21) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6.73E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of B-raf V600E mutant-mediated Erk phosphorylation in human Malme3 cells |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485088
(CHEMBL2030225)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3occc3c2)c1F Show InChI InChI=1S/C17H15F2N3O4S/c1-2-7-27(24,25)22-13-4-3-12(18)14(15(13)19)16(23)21-11-8-10-5-6-26-17(10)20-9-11/h3-6,8-9,22H,2,7H2,1H3,(H,21,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase B-raf
(Homo sapiens (Human)) | BDBM50485107
(CHEMBL2030226)Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Nc2cnc3nccn3c2)c1F Show InChI InChI=1S/C16H15F2N5O3S/c1-2-7-27(25,26)22-12-4-3-11(17)13(14(12)18)15(24)21-10-8-20-16-19-5-6-23(16)9-10/h3-6,8-9,22H,2,7H2,1H3,(H,21,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Array BioPharma, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of full-length B-raf V600E mutant |
Bioorg Med Chem Lett 22: 1165-8 (2012)
Article DOI: 10.1016/j.bmcl.2011.11.092
BindingDB Entry DOI: 10.7270/Q2RB77GQ |
More data for this
Ligand-Target Pair | |
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