Found 9 hits of kd for UniProtKB: P49638 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Alpha-tocopherol transfer protein
(Homo sapiens) | BDBM50481298
(CHEMBL247483)Show SMILES CC(C)CCCC(C)CCCC(C)CCCC1(C)CCc2c(CO[N+]([O-])=O)c(OC(C)=O)c(C)c(C)c2O1 Show InChI InChI=1S/C31H51NO6/c1-21(2)12-9-13-22(3)14-10-15-23(4)16-11-18-31(8)19-17-27-28(20-36-32(34)35)29(37-26(7)33)24(5)25(6)30(27)38-31/h21-23H,9-20H2,1-8H3 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 360 | n/a | n/a | n/a | n/a | n/a |
Universidad de la Rep£blica
Curated by ChEMBL
| Assay Description Displacement of NBD-Toc from human recombinant alphaTTP |
Bioorg Med Chem 17: 8143-8 (2009)
Article DOI: 10.1016/j.bmc.2009.10.046 BindingDB Entry DOI: 10.7270/Q2K93BBR |
More data for this Ligand-Target Pair | |
Alpha-tocopherol transfer protein
(Homo sapiens) | BDBM50481297
(CHEMBL595636)Show SMILES CC(C)CCCC(C)CCCC(C)CCCC1(C)CCc2c(CO[N+]([O-])=O)c(O)c(C)c(C)c2O1 Show InChI InChI=1S/C29H49NO5/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-29(7)18-16-25-26(19-34-30(32)33)27(31)23(5)24(6)28(25)35-29/h20-22,31H,8-19H2,1-7H3 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 1.13E+3 | n/a | n/a | n/a | n/a | n/a |
Universidad de la Rep£blica
Curated by ChEMBL
| Assay Description Displacement of NBD-Toc from human recombinant alphaTTP |
Bioorg Med Chem 17: 8143-8 (2009)
Article DOI: 10.1016/j.bmc.2009.10.046 BindingDB Entry DOI: 10.7270/Q2K93BBR |
More data for this Ligand-Target Pair | |
Alpha-tocopherol transfer protein
(Homo sapiens) | BDBM50481301
(CHEMBL391747)Show SMILES Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)OCCCOc1no[n+]([O-])c1S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C25H28N2O9S/c1-15-16(2)21-19(17(3)20(15)28)11-12-25(4,35-21)24(29)34-14-8-13-33-22-23(27(30)36-26-22)37(31,32)18-9-6-5-7-10-18/h5-7,9-10,28H,8,11-14H2,1-4H3 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 2.19E+3 | n/a | n/a | n/a | n/a | n/a |
Universidad de la Rep£blica
Curated by ChEMBL
| Assay Description Displacement of NBD-Toc from human recombinant alphaTTP |
Bioorg Med Chem 17: 8143-8 (2009)
Article DOI: 10.1016/j.bmc.2009.10.046 BindingDB Entry DOI: 10.7270/Q2K93BBR |
More data for this Ligand-Target Pair | |
Alpha-tocopherol transfer protein
(Homo sapiens) | BDBM50481302
(CHEMBL594042)Show SMILES Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)OCCOc1no[n+]([O-])c1S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C24H26N2O9S/c1-14-15(2)20-18(16(3)19(14)27)10-11-24(4,34-20)23(28)33-13-12-32-21-22(26(29)35-25-21)36(30,31)17-8-6-5-7-9-17/h5-9,27H,10-13H2,1-4H3 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 2.39E+3 | n/a | n/a | n/a | n/a | n/a |
Universidad de la Rep£blica
Curated by ChEMBL
| Assay Description Displacement of NBD-Toc from human recombinant alphaTTP |
Bioorg Med Chem 17: 8143-8 (2009)
Article DOI: 10.1016/j.bmc.2009.10.046 BindingDB Entry DOI: 10.7270/Q2K93BBR |
More data for this Ligand-Target Pair | |
Alpha-tocopherol transfer protein
(Homo sapiens) | BDBM50458513
(Alpha Tocopherol | Aquasol E | CHEBI:18145 | E307 ...)Show SMILES CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCc2c(C)c(O)c(C)c(C)c2O1 |r| Show InChI InChI=1S/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3/t21-,22-,29-/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
MCE KEGG PC cid PC sid PDB UniChem
| PDB Article PubMed
| n/a | n/a | n/a | 2.42E+3 | n/a | n/a | n/a | n/a | n/a |
Universidad de la Rep£blica
Curated by ChEMBL
| Assay Description Displacement of NBD-Toc from human recombinant alphaTTP |
Bioorg Med Chem 17: 8143-8 (2009)
Article DOI: 10.1016/j.bmc.2009.10.046 BindingDB Entry DOI: 10.7270/Q2K93BBR |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Alpha-tocopherol transfer protein
(Homo sapiens) | BDBM50481304
(CHEMBL391748)Show SMILES CC(=O)Oc1c(C)c(C)c2OC(C)(CCc2c1C)C(=O)OCCCO[N+]([O-])=O Show InChI InChI=1S/C19H25NO8/c1-11-12(2)17-15(13(3)16(11)27-14(4)21)7-8-19(5,28-17)18(22)25-9-6-10-26-20(23)24/h6-10H2,1-5H3 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 4.00E+4 | n/a | n/a | n/a | n/a | n/a |
Universidad de la Rep£blica
Curated by ChEMBL
| Assay Description Displacement of NBD-Toc from human recombinant alphaTTP |
Bioorg Med Chem 17: 8143-8 (2009)
Article DOI: 10.1016/j.bmc.2009.10.046 BindingDB Entry DOI: 10.7270/Q2K93BBR |
More data for this Ligand-Target Pair | |
Alpha-tocopherol transfer protein
(Homo sapiens) | BDBM50481300
(CHEMBL248495)Show SMILES CC(=O)Oc1c(C)c(C)c2OC(C)(CCc2c1C)C(=O)NCCO[N+]([O-])=O Show InChI InChI=1S/C18H24N2O7/c1-10-11(2)16-14(12(3)15(10)26-13(4)21)6-7-18(5,27-16)17(22)19-8-9-25-20(23)24/h6-9H2,1-5H3,(H,19,22) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 6.00E+4 | n/a | n/a | n/a | n/a | n/a |
Universidad de la Rep£blica
Curated by ChEMBL
| Assay Description Displacement of NBD-Toc from human recombinant alphaTTP |
Bioorg Med Chem 17: 8143-8 (2009)
Article DOI: 10.1016/j.bmc.2009.10.046 BindingDB Entry DOI: 10.7270/Q2K93BBR |
More data for this Ligand-Target Pair | |
Alpha-tocopherol transfer protein
(Homo sapiens) | BDBM50481303
(CHEMBL593785)Show SMILES Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)NCCO[N+]([O-])=O Show InChI InChI=1S/C16H22N2O6/c1-9-10(2)14-12(11(3)13(9)19)5-6-16(4,24-14)15(20)17-7-8-23-18(21)22/h19H,5-8H2,1-4H3,(H,17,20) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 1.08E+5 | n/a | n/a | n/a | n/a | n/a |
Universidad de la Rep£blica
Curated by ChEMBL
| Assay Description Displacement of NBD-Toc from human recombinant alphaTTP |
Bioorg Med Chem 17: 8143-8 (2009)
Article DOI: 10.1016/j.bmc.2009.10.046 BindingDB Entry DOI: 10.7270/Q2K93BBR |
More data for this Ligand-Target Pair | |
Alpha-tocopherol transfer protein
(Homo sapiens) | BDBM50481299
(CHEMBL247276)Show SMILES Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)OCCCO[N+]([O-])=O Show InChI InChI=1S/C17H23NO7/c1-10-11(2)15-13(12(3)14(10)19)6-7-17(4,25-15)16(20)23-8-5-9-24-18(21)22/h19H,5-9H2,1-4H3 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 1.65E+5 | n/a | n/a | n/a | n/a | n/a |
Universidad de la Rep£blica
Curated by ChEMBL
| Assay Description Displacement of NBD-Toc from human recombinant alphaTTP |
Bioorg Med Chem 17: 8143-8 (2009)
Article DOI: 10.1016/j.bmc.2009.10.046 BindingDB Entry DOI: 10.7270/Q2K93BBR |
More data for this Ligand-Target Pair | |