Found 18 hits Enz. Inhib. hit(s) with all data for entry = 50048586 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 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223720
(CHEMBL332257)Show SMILES CCCCCC(CCCCC)c1nc(c[nH]1)-c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C26H34N2/c1-3-5-8-14-24(15-9-6-4-2)26-27-20-25(28-26)23-18-16-22(17-19-23)21-12-10-7-11-13-21/h7,10-13,16-20,24H,3-6,8-9,14-15H2,1-2H3,(H,27,28) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223731
(CHEMBL118603)Show InChI InChI=1S/C21H24N2/c1-2-3-4-8-11-21-22-16-20(23-21)19-14-12-18(13-15-19)17-9-6-5-7-10-17/h5-7,9-10,12-16H,2-4,8,11H2,1H3,(H,22,23) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223721
(CHEMBL331513)Show SMILES C(CC1CCCCC1)Cc1nc(c[nH]1)-c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H28N2/c1-3-8-19(9-4-1)10-7-13-24-25-18-23(26-24)22-16-14-21(15-17-22)20-11-5-2-6-12-20/h2,5-6,11-12,14-19H,1,3-4,7-10,13H2,(H,25,26) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223726
(CHEMBL117331)Show InChI InChI=1S/C20H29FN2/c1-3-5-7-9-17(10-8-6-4-2)20-22-15-19(23-20)16-11-13-18(21)14-12-16/h11-15,17H,3-10H2,1-2H3,(H,22,23) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223735
(CHEMBL119139)Show SMILES C(Cc1nc(c[nH]1)-c1ccc(cc1)-c1ccccc1)C1CCCCC1 Show InChI InChI=1S/C23H26N2/c1-3-7-18(8-4-1)11-16-23-24-17-22(25-23)21-14-12-20(13-15-21)19-9-5-2-6-10-19/h2,5-6,9-10,12-15,17-18H,1,3-4,7-8,11,16H2,(H,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223734
(CHEMBL331942)Show InChI InChI=1S/C19H28N2/c1-4-5-6-7-8-19-20-14-18(21-19)17-11-9-16(10-12-17)13-15(2)3/h9-12,14-15H,4-8,13H2,1-3H3,(H,20,21) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223733
(CHEMBL120306)Show InChI InChI=1S/C20H30N2/c1-6-8-16(9-7-2)19-21-14-18(22-19)15-10-12-17(13-11-15)20(3,4)5/h10-14,16H,6-9H2,1-5H3,(H,21,22) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223722
(CHEMBL334104)Show SMILES C(C1CCCCC1)c1nc(c[nH]1)-c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C22H24N2/c1-3-7-17(8-4-1)15-22-23-16-21(24-22)20-13-11-19(12-14-20)18-9-5-2-6-10-18/h2,5-6,9-14,16-17H,1,3-4,7-8,15H2,(H,23,24) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223723
(CHEMBL119494)Show InChI InChI=1S/C20H30N2/c1-3-5-8-14-18(15-9-6-4-2)20-21-16-19(22-20)17-12-10-7-11-13-17/h7,10-13,16,18H,3-6,8-9,14-15H2,1-2H3,(H,21,22) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 86 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223725
(CHEMBL118682)Show InChI InChI=1S/C22H26N2/c1-3-8-20(9-4-2)22-23-16-21(24-22)19-14-12-18(13-15-19)17-10-6-5-7-11-17/h5-7,10-16,20H,3-4,8-9H2,1-2H3,(H,23,24) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223729
(CHEMBL418863)Show InChI InChI=1S/C16H19FN2/c17-14-8-6-13(7-9-14)15-11-18-16(19-15)10-12-4-2-1-3-5-12/h6-9,11-12H,1-5,10H2,(H,18,19) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 146 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223732
(CHEMBL118626)Show SMILES CCCC(CCC)c1nc(c[nH]1)-c1ccc(cc1)-c1ccc(Br)cc1 Show InChI InChI=1S/C22H25BrN2/c1-3-5-19(6-4-2)22-24-15-21(25-22)18-9-7-16(8-10-18)17-11-13-20(23)14-12-17/h7-15,19H,3-6H2,1-2H3,(H,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 322 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223728
(CHEMBL119103)Show InChI InChI=1S/C16H21FN2/c1-3-5-13(6-4-2)16-18-11-15(19-16)12-7-9-14(17)10-8-12/h7-11,13H,3-6H2,1-2H3,(H,18,19) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 518 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223727
(CHEMBL330800)Show InChI InChI=1S/C16H14N2/c1-12-17-11-16(18-12)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50223730
(CHEMBL3037819)Show SMILES C1[C@@H](N[C@@H](c2[nH]c3ccccc3c12)c1ccccc1)c1nc(c[nH]1)-c1ccccc1 Show InChI InChI=1S/C26H22N4/c1-3-9-17(10-4-1)23-16-27-26(30-23)22-15-20-19-13-7-8-14-21(19)28-25(20)24(29-22)18-11-5-2-6-12-18/h1-14,16,22,24,28-29H,15H2,(H,27,30)/t22-,24-/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50031299
(6-(2,3-Dichloro-phenyl)-[1,2,4]triazine-3,5-diamin...)Show InChI InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Patents
| PubMed
| n/a | n/a | 3.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50017662
(2-(Diethylamino)-2',6'-acetoxylidide | 2-(Diethyla...)Show InChI InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 5.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 1/2/3 subunit alpha
(Rattus norvegicus) | BDBM50003659
(5H-dibenzo[b,f]azepine-5-carboxamide | CARBAMAZEPI...)Show InChI InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 1.67E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut Henri Beaufour
Curated by ChEMBL
| Assay Description
Concentration required to inhibit [3H]BTX binding to Sodium channel of rat brain |
Bioorg Med Chem Lett 14: 3521-3 (2004)
BindingDB Entry DOI: 10.7270/Q2474D2N |
More data for this
Ligand-Target Pair | |
Search and Browse
