Found 25 hits Enz. Inhib. hit(s) with all data for entry = 50039847 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 |
|---|
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385105
(CHEMBL2035874 | US10322118, Entry 8b)Show SMILES CC(C)c1cc(Oc2c(Br)cc(NC(=O)CC(O)=O)cc2Br)ccc1O Show InChI InChI=1S/C18H17Br2NO5/c1-9(2)12-7-11(3-4-15(12)22)26-18-13(19)5-10(6-14(18)20)21-16(23)8-17(24)25/h3-7,9,22H,8H2,1-2H3,(H,21,23)(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
PDB
UniChem
| Article
PubMed
| 0.430 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385109
(CHEMBL2035879)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(NC(=O)CC(O)=O)cc2Br)ccc1O Show InChI InChI=1S/C21H22BrNO5/c1-11(2)15-8-12(6-7-18(15)24)28-21-14-5-3-4-13(14)17(9-16(21)22)23-19(25)10-20(26)27/h6-9,11,24H,3-5,10H2,1-2H3,(H,23,25)(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385101
(CHEMBL2035876)Show SMILES CC(C)c1cc(Oc2c(Cl)cc(NC(=O)CC(O)=O)c(Cl)c2Cl)ccc1O Show InChI InChI=1S/C18H16Cl3NO5/c1-8(2)10-5-9(3-4-13(10)23)27-18-11(19)6-12(16(20)17(18)21)22-14(24)7-15(25)26/h3-6,8,23H,7H2,1-2H3,(H,22,24)(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| 1.54 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM18860
((2R)-2-amino-3-[4-(4-hydroxy-3-iodophenoxy)-3,5-di...)Show SMILES N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(O)=O |r| Show InChI InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
PDB
Article
PubMed
| 2.29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM18860
((2R)-2-amino-3-[4-(4-hydroxy-3-iodophenoxy)-3,5-di...)Show SMILES N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(O)=O |r| Show InChI InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
PDB
Article
PubMed
| 2.33 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385111
(CHEMBL2035881)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(NC(=O)C(O)=O)cc2C)ccc1O Show InChI InChI=1S/C21H23NO5/c1-11(2)16-10-13(7-8-18(16)23)27-19-12(3)9-17(22-20(24)21(25)26)14-5-4-6-15(14)19/h7-11,23H,4-6H2,1-3H3,(H,22,24)(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.45 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385111
(CHEMBL2035881)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(NC(=O)C(O)=O)cc2C)ccc1O Show InChI InChI=1S/C21H23NO5/c1-11(2)16-10-13(7-8-18(16)23)27-19-12(3)9-17(22-20(24)21(25)26)14-5-4-6-15(14)19/h7-11,23H,4-6H2,1-3H3,(H,22,24)(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.59 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385108
(CHEMBL2035878)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(NC(=O)CC(O)=O)cc2C)ccc1O Show InChI InChI=1S/C22H25NO5/c1-12(2)17-10-14(7-8-19(17)24)28-22-13(3)9-18(15-5-4-6-16(15)22)23-20(25)11-21(26)27/h7-10,12,24H,4-6,11H2,1-3H3,(H,23,25)(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385105
(CHEMBL2035874 | US10322118, Entry 8b)Show SMILES CC(C)c1cc(Oc2c(Br)cc(NC(=O)CC(O)=O)cc2Br)ccc1O Show InChI InChI=1S/C18H17Br2NO5/c1-9(2)12-7-11(3-4-15(12)22)26-18-13(19)5-10(6-14(18)20)21-16(23)8-17(24)25/h3-7,9,22H,8H2,1-2H3,(H,21,23)(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
PDB
UniChem
| Article
PubMed
| 9.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385106
(CHEMBL2035875)Show SMILES CC(C)c1cc(Oc2c(C)cc(NC(=O)CC(O)=O)cc2C)ccc1O Show InChI InChI=1S/C20H23NO5/c1-11(2)16-9-15(5-6-17(16)22)26-20-12(3)7-14(8-13(20)4)21-18(23)10-19(24)25/h5-9,11,22H,10H2,1-4H3,(H,21,23)(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385102
(CHEMBL2035882)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(cc2C)C(=O)NCC(O)=O)ccc1O Show InChI InChI=1S/C22H25NO5/c1-12(2)17-10-14(7-8-19(17)24)28-21-13(3)9-18(15-5-4-6-16(15)21)22(27)23-11-20(25)26/h7-10,12,24H,4-6,11H2,1-3H3,(H,23,27)(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 15.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385104
(CHEMBL2035884)Show SMILES CC(C)c1cc(Cc2c3CCCc3c(NC(=O)CC(O)=O)cc2C)ccc1O Show InChI InChI=1S/C23H27NO4/c1-13(2)18-10-15(7-8-21(18)25)11-19-14(3)9-20(17-6-4-5-16(17)19)24-22(26)12-23(27)28/h7-10,13,25H,4-6,11-12H2,1-3H3,(H,24,26)(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 19.7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385107
(CHEMBL2035877)Show SMILES CC(C)c1cc(Oc2c(C)cc(NC(=O)CC(O)=O)c(C)c2C)ccc1O Show InChI InChI=1S/C21H25NO5/c1-11(2)16-9-15(6-7-18(16)23)27-21-12(3)8-17(13(4)14(21)5)22-19(24)10-20(25)26/h6-9,11,23H,10H2,1-5H3,(H,22,24)(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 20.3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385101
(CHEMBL2035876)Show SMILES CC(C)c1cc(Oc2c(Cl)cc(NC(=O)CC(O)=O)c(Cl)c2Cl)ccc1O Show InChI InChI=1S/C18H16Cl3NO5/c1-8(2)10-5-9(3-4-13(10)23)27-18-11(19)6-12(16(20)17(18)21)22-14(24)7-15(25)26/h3-6,8,23H,7H2,1-2H3,(H,22,24)(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| 24.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385112
(CHEMBL2035885)Show SMILES CC(C)c1cc(ccc1O)C(=O)c1c2CCCc2c(NC(=O)CC(O)=O)cc1C Show InChI InChI=1S/C23H25NO5/c1-12(2)17-10-14(7-8-19(17)25)23(29)22-13(3)9-18(15-5-4-6-16(15)22)24-20(26)11-21(27)28/h7-10,12,25H,4-6,11H2,1-3H3,(H,24,26)(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 59 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385109
(CHEMBL2035879)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(NC(=O)CC(O)=O)cc2Br)ccc1O Show InChI InChI=1S/C21H22BrNO5/c1-11(2)15-8-12(6-7-18(15)24)28-21-14-5-3-4-13(14)17(9-16(21)22)23-19(25)10-20(26)27/h6-9,11,24H,3-5,10H2,1-2H3,(H,23,25)(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 69.3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385102
(CHEMBL2035882)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(cc2C)C(=O)NCC(O)=O)ccc1O Show InChI InChI=1S/C22H25NO5/c1-12(2)17-10-14(7-8-19(17)24)28-21-13(3)9-18(15-5-4-6-16(15)21)22(27)23-11-20(25)26/h7-10,12,24H,4-6,11H2,1-3H3,(H,23,27)(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 127 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385106
(CHEMBL2035875)Show SMILES CC(C)c1cc(Oc2c(C)cc(NC(=O)CC(O)=O)cc2C)ccc1O Show InChI InChI=1S/C20H23NO5/c1-11(2)16-9-15(5-6-17(16)22)26-20-12(3)7-14(8-13(20)4)21-18(23)10-19(24)25/h5-9,11,22H,10H2,1-4H3,(H,21,23)(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 147 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385104
(CHEMBL2035884)Show SMILES CC(C)c1cc(Cc2c3CCCc3c(NC(=O)CC(O)=O)cc2C)ccc1O Show InChI InChI=1S/C23H27NO4/c1-13(2)18-10-15(7-8-21(18)25)11-19-14(3)9-20(17-6-4-5-16(17)19)24-22(26)12-23(27)28/h7-10,13,25H,4-6,11-12H2,1-3H3,(H,24,26)(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 154 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385108
(CHEMBL2035878)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(NC(=O)CC(O)=O)cc2C)ccc1O Show InChI InChI=1S/C22H25NO5/c1-12(2)17-10-14(7-8-19(17)24)28-22-13(3)9-18(15-5-4-6-16(15)22)23-20(25)11-21(26)27/h7-10,12,24H,4-6,11H2,1-3H3,(H,23,25)(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 172 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385107
(CHEMBL2035877)Show SMILES CC(C)c1cc(Oc2c(C)cc(NC(=O)CC(O)=O)c(C)c2C)ccc1O Show InChI InChI=1S/C21H25NO5/c1-11(2)16-9-15(6-7-18(16)23)27-21-12(3)8-17(13(4)14(21)5)22-19(24)10-20(25)26/h6-9,11,23H,10H2,1-5H3,(H,22,24)(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 195 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385103
(CHEMBL2035883)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(NS(=O)(=O)CC(O)=O)cc2C)ccc1O Show InChI InChI=1S/C21H25NO6S/c1-12(2)17-10-14(7-8-19(17)23)28-21-13(3)9-18(15-5-4-6-16(15)21)22-29(26,27)11-20(24)25/h7-10,12,22-23H,4-6,11H2,1-3H3,(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 213 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385110
(CHEMBL2035880)Show SMILES CC(C)c1cc(Oc2c(Br)cc(NC(=O)CC(O)=O)c3CCCCc23)ccc1O Show InChI InChI=1S/C22H24BrNO5/c1-12(2)16-9-13(7-8-19(16)25)29-22-15-6-4-3-5-14(15)18(10-17(22)23)24-20(26)11-21(27)28/h7-10,12,25H,3-6,11H2,1-2H3,(H,24,26)(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor beta
(Homo sapiens (Human)) | BDBM50385110
(CHEMBL2035880)Show SMILES CC(C)c1cc(Oc2c(Br)cc(NC(=O)CC(O)=O)c3CCCCc23)ccc1O Show InChI InChI=1S/C22H24BrNO5/c1-12(2)16-9-13(7-8-19(16)25)29-22-15-6-4-3-5-14(15)18(10-17(22)23)24-20(26)11-21(27)28/h7-10,12,25H,3-6,11H2,1-2H3,(H,24,26)(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 301 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor beta after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
Thyroid hormone receptor alpha
(Homo sapiens (Human)) | BDBM50385103
(CHEMBL2035883)Show SMILES CC(C)c1cc(Oc2c3CCCc3c(NS(=O)(=O)CC(O)=O)cc2C)ccc1O Show InChI InChI=1S/C21H25NO6S/c1-12(2)17-10-14(7-8-19(17)23)28-21-13(3)9-18(15-5-4-6-16(15)21)22-29(26,27)11-20(24)25/h7-10,12,22-23H,4-6,11H2,1-3H3,(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.25E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kissei Pharmaceutical Co., Ltd
Curated by ChEMBL
| Assay Description
Displacement of [125I]T3 from human recombinant thyroid harmone receptor alpha after 16 to 48 hrs by gamma-ray detection |
Bioorg Med Chem 20: 3622-34 (2012)
Article DOI: 10.1016/j.bmc.2012.03.056
BindingDB Entry DOI: 10.7270/Q2SF2X6V |
More data for this
Ligand-Target Pair | |
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