Found 24 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 |
|---|
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235501
(CHEMBL254707 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Show InChI InChI=1S/C29H35F3N4O4/c1-28(2,3)40-27(39)34-21(15-19-9-5-4-6-10-19)25(37)33-22-17-35(16-20-13-14-20)23-11-7-8-12-24(23)36(26(22)38)18-29(30,31)32/h4-12,20-22H,13-18H2,1-3H3,(H,33,37)(H,34,39)/t21-,22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells at a membrane potential of -70 mV by whole cell voltage clamp technique |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235499
(CHEMBL438869 | tert-butyl (R)-1-((R)-5-benzyl-1-me...)Show SMILES CN1c2ccccc2N(Cc2ccccc2)C[C@@H](NC(=O)[C@@H](Cc2ccccc2F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C31H35FN4O4/c1-31(2,3)40-30(39)34-24(18-22-14-8-9-15-23(22)32)28(37)33-25-20-36(19-21-12-6-5-7-13-21)27-17-11-10-16-26(27)35(4)29(25)38/h5-17,24-25H,18-20H2,1-4H3,(H,33,37)(H,34,39)/t24-,25-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235501
(CHEMBL254707 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Show InChI InChI=1S/C29H35F3N4O4/c1-28(2,3)40-27(39)34-21(15-19-9-5-4-6-10-19)25(37)33-22-17-35(16-20-13-14-20)23-11-7-8-12-24(23)36(26(22)38)18-29(30,31)32/h4-12,20-22H,13-18H2,1-3H3,(H,33,37)(H,34,39)/t21-,22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50216671
(CHEMBL247828 | tert-butyl (R)-1-((R)-1-isopropyl-2...)Show SMILES CC(C)N1c2ccccc2CC[C@@H](NC(=O)[C@@H](Cc2ccccc2OC(F)(F)F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C28H34F3N3O5/c1-17(2)34-22-12-8-6-10-18(22)14-15-20(25(34)36)32-24(35)21(33-26(37)39-27(3,4)5)16-19-11-7-9-13-23(19)38-28(29,30)31/h6-13,17,20-21H,14-16H2,1-5H3,(H,32,35)(H,33,37)/t20-,21-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235517
(CHEMBL254699 | tert-butyl (R)-3-(2-fluorophenyl)-1...)Show SMILES CN1c2ccccc2N(CC(F)(F)F)C[C@@H](NC(=O)[C@@H](Cc2ccccc2F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C26H30F4N4O4/c1-25(2,3)38-24(37)32-18(13-16-9-5-6-10-17(16)27)22(35)31-19-14-34(15-26(28,29)30)21-12-8-7-11-20(21)33(4)23(19)36/h5-12,18-19H,13-15H2,1-4H3,(H,31,35)(H,32,37)/t18-,19-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
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DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235512
(CHEMBL401343 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CN1c2ccccc2N(CC2CC2)C[C@@H](NC(=O)[C@@H](Cc2ccccc2F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C28H35FN4O4/c1-28(2,3)37-27(36)31-21(15-19-9-5-6-10-20(19)29)25(34)30-22-17-33(16-18-13-14-18)24-12-8-7-11-23(24)32(4)26(22)35/h5-12,18,21-22H,13-17H2,1-4H3,(H,30,34)(H,31,36)/t21-,22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 49 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235513
(CHEMBL399886 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)N1c2ccccc2N(CC2CC2)C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C30H40N4O4/c1-20(2)34-26-14-10-9-13-25(26)33(18-22-15-16-22)19-24(28(34)36)31-27(35)23(17-21-11-7-6-8-12-21)32-29(37)38-30(3,4)5/h6-14,20,22-24H,15-19H2,1-5H3,(H,31,35)(H,32,37)/t23-,24-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235511
(CHEMBL253819 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccccc1OC(F)(F)F)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Show InChI InChI=1S/C30H34F6N4O5/c1-28(2,3)45-27(43)38-20(14-19-8-4-7-11-24(19)44-30(34,35)36)25(41)37-21-16-39(15-18-12-13-18)22-9-5-6-10-23(22)40(26(21)42)17-29(31,32)33/h4-11,18,20-21H,12-17H2,1-3H3,(H,37,41)(H,38,43)/t20-,21-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 73 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235510
(CHEMBL254928 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)N1c2ccccc2N(CC2CC2)C[C@@H](NC(=O)[C@@H](Cc2ccccc2OC(F)(F)F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C31H39F3N4O5/c1-19(2)38-25-12-8-7-11-24(25)37(17-20-14-15-20)18-23(28(38)40)35-27(39)22(36-29(41)43-30(3,4)5)16-21-10-6-9-13-26(21)42-31(32,33)34/h6-13,19-20,22-23H,14-18H2,1-5H3,(H,35,39)(H,36,41)/t22-,23-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 75 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235498
(CHEMBL253877 | tert-butyl (R)-1-((R)-5-(cyclobutyl...)Show SMILES CN1c2ccccc2N(CC2CCC2)C[C@@H](NC(=O)[C@@H](Cc2ccccc2F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C29H37FN4O4/c1-29(2,3)38-28(37)32-22(16-20-12-5-6-13-21(20)30)26(35)31-23-18-34(17-19-10-9-11-19)25-15-8-7-14-24(25)33(4)27(23)36/h5-8,12-15,19,22-23H,9-11,16-18H2,1-4H3,(H,31,35)(H,32,37)/t22-,23-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 81 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235506
(CHEMBL252783 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)N1c2ccccc2N(CC2CC2)C[C@@H](NC(=O)[C@@H](Cc2cccc(F)c2)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C30H39FN4O4/c1-19(2)35-26-12-7-6-11-25(26)34(17-20-13-14-20)18-24(28(35)37)32-27(36)23(33-29(38)39-30(3,4)5)16-21-9-8-10-22(31)15-21/h6-12,15,19-20,23-24H,13-14,16-18H2,1-5H3,(H,32,36)(H,33,38)/t23-,24-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 96 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235516
(CHEMBL400293 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)N1c2ccccc2N(CC2CC2)C[C@@H](NC(=O)[C@@H](Cc2c(F)cccc2F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C30H38F2N4O4/c1-18(2)36-26-12-7-6-11-25(26)35(16-19-13-14-19)17-24(28(36)38)33-27(37)23(34-29(39)40-30(3,4)5)15-20-21(31)9-8-10-22(20)32/h6-12,18-19,23-24H,13-17H2,1-5H3,(H,33,37)(H,34,39)/t23-,24-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 97 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235502
(CHEMBL254079 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccccc1F)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Show InChI InChI=1S/C29H34F4N4O4/c1-28(2,3)41-27(40)35-21(14-19-8-4-5-9-20(19)30)25(38)34-22-16-36(15-18-12-13-18)23-10-6-7-11-24(23)37(26(22)39)17-29(31,32)33/h4-11,18,21-22H,12-17H2,1-3H3,(H,34,38)(H,35,40)/t21-,22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 101 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235497
(CHEMBL428421 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)N1c2ccccc2N(CC2CC2)C[C@@H](NC(=O)[C@@H](Cc2ccccc2F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C30H39FN4O4/c1-19(2)35-26-13-9-8-12-25(26)34(17-20-14-15-20)18-24(28(35)37)32-27(36)23(33-29(38)39-30(3,4)5)16-21-10-6-7-11-22(21)31/h6-13,19-20,23-24H,14-18H2,1-5H3,(H,32,36)(H,33,38)/t23-,24-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 102 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235500
(CHEMBL399273 | tert-butyl (R)-3-(2,5-bis(trifluoro...)Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1cc(ccc1C(F)(F)F)C(F)(F)F)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Show InChI InChI=1S/C31H33F9N4O4/c1-28(2,3)48-27(47)42-21(13-18-12-19(30(35,36)37)10-11-20(18)31(38,39)40)25(45)41-22-15-43(14-17-8-9-17)23-6-4-5-7-24(23)44(26(22)46)16-29(32,33)34/h4-7,10-12,17,21-22H,8-9,13-16H2,1-3H3,(H,41,45)(H,42,47)/t21-,22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235509
(CHEMBL399041 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccccc1C(F)(F)F)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Show InChI InChI=1S/C30H34F6N4O4/c1-28(2,3)44-27(43)38-21(14-19-8-4-5-9-20(19)30(34,35)36)25(41)37-22-16-39(15-18-12-13-18)23-10-6-7-11-24(23)40(26(22)42)17-29(31,32)33/h4-11,18,21-22H,12-17H2,1-3H3,(H,37,41)(H,38,43)/t21-,22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 131 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235508
(CHEMBL254698 | tert-butyl (R)-1-((R)-1,5-dimethyl-...)Show SMILES CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2F)NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccc12 Show InChI InChI=1S/C25H31FN4O4/c1-25(2,3)34-24(33)28-18(14-16-10-6-7-11-17(16)26)22(31)27-19-15-29(4)20-12-8-9-13-21(20)30(5)23(19)32/h6-13,18-19H,14-15H2,1-5H3,(H,27,31)(H,28,33)/t18-,19-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 142 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235514
(CHEMBL254914 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Show InChI InChI=1S/C29H34F4N4O4/c1-28(2,3)41-27(40)35-21(14-19-7-6-8-20(30)13-19)25(38)34-22-16-36(15-18-11-12-18)23-9-4-5-10-24(23)37(26(22)39)17-29(31,32)33/h4-10,13,18,21-22H,11-12,14-17H2,1-3H3,(H,34,38)(H,35,40)/t21-,22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 142 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235507
(CHEMBL252212 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)N1c2ccccc2N(CC2CC2)C[C@@H](NC(=O)[C@@H](Cc2ccccc2C(F)(F)F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C31H39F3N4O4/c1-19(2)38-26-13-9-8-12-25(26)37(17-20-14-15-20)18-24(28(38)40)35-27(39)23(36-29(41)42-30(3,4)5)16-21-10-6-7-11-22(21)31(32,33)34/h6-13,19-20,23-24H,14-18H2,1-5H3,(H,35,39)(H,36,41)/t23-,24-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 149 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235504
(CHEMBL253627 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccc(F)cc1F)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Show InChI InChI=1S/C29H33F5N4O4/c1-28(2,3)42-27(41)36-21(12-18-10-11-19(30)13-20(18)31)25(39)35-22-15-37(14-17-8-9-17)23-6-4-5-7-24(23)38(26(22)40)16-29(32,33)34/h4-7,10-11,13,17,21-22H,8-9,12,14-16H2,1-3H3,(H,35,39)(H,36,41)/t21-,22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 185 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235505
(CHEMBL254078 | tert-butyl (R)-1-((R)-5-(cyclohexyl...)Show SMILES CN1c2ccccc2N(CC2CCCCC2)C[C@@H](NC(=O)[C@@H](Cc2ccccc2F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C31H41FN4O4/c1-31(2,3)40-30(39)34-24(18-22-14-8-9-15-23(22)32)28(37)33-25-20-36(19-21-12-6-5-7-13-21)27-17-11-10-16-26(27)35(4)29(25)38/h8-11,14-17,21,24-25H,5-7,12-13,18-20H2,1-4H3,(H,33,37)(H,34,39)/t24-,25-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 188 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235503
(CHEMBL252985 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)N1c2ccccc2N(CC2CC2)C[C@@H](NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C30H39FN4O4/c1-19(2)35-26-9-7-6-8-25(26)34(17-21-10-11-21)18-24(28(35)37)32-27(36)23(33-29(38)39-30(3,4)5)16-20-12-14-22(31)15-13-20/h6-9,12-15,19,21,23-24H,10-11,16-18H2,1-5H3,(H,32,36)(H,33,38)/t23-,24-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 196 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235515
(CHEMBL254915 | tert-butyl (R)-1-((R)-5-(cyclopropy...)Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Show InChI InChI=1S/C29H34F4N4O4/c1-28(2,3)41-27(40)35-21(14-18-10-12-20(30)13-11-18)25(38)34-22-16-36(15-19-8-9-19)23-6-4-5-7-24(23)37(26(22)39)17-29(31,32)33/h4-7,10-13,19,21-22H,8-9,14-17H2,1-3H3,(H,34,38)(H,35,40)/t21-,22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 219 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50235496
(CHEMBL399589 | tert-butyl (R)-3-(2-fluorophenyl)-1...)Show SMILES CN1c2ccccc2NC[C@@H](NC(=O)[C@@H](Cc2ccccc2F)NC(=O)OC(C)(C)C)C1=O Show InChI InChI=1S/C24H29FN4O4/c1-24(2,3)33-23(32)28-18(13-15-9-5-6-10-16(15)25)21(30)27-19-14-26-17-11-7-8-12-20(17)29(4)22(19)31/h5-12,18-19,26H,13-14H2,1-4H3,(H,27,30)(H,28,32)/t18-,19-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 409 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 sodium channel expressed in HEK293 cells by FRET assay |
Bioorg Med Chem Lett 18: 1963-6 (2008)
Article DOI: 10.1016/j.bmcl.2008.01.123
BindingDB Entry DOI: 10.7270/Q24T6J4T |
More data for this
Ligand-Target Pair | |
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