Found 4 hits in this display 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 |
Peptidyl-prolyl cis-trans isomerase FKBP5
(Homo sapiens (Human)) | BDBM50388294
(CHEMBL2058790)Show SMILES COc1ccc(OCCOC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cc(Cl)cc(Cl)c2)cc1OC |r| Show InChI InChI=1S/C22H25Cl2NO7S/c1-29-20-7-6-17(14-21(20)30-2)31-9-10-32-22(26)19-5-3-4-8-25(19)33(27,28)18-12-15(23)11-16(24)13-18/h6-7,11-14,19H,3-5,8-10H2,1-2H3/t19-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Max Institute of Psychiatry
Curated by ChEMBL
| Assay Description Binding affinity to human FKBP51 by competitive fluorescence polarization assay |
J Med Chem 56: 3922-35 (2013)
Article DOI: 10.1021/jm400087k BindingDB Entry DOI: 10.7270/Q2QZ2CC1 |
More data for this Ligand-Target Pair | |
Peptidyl-prolyl cis-trans isomerase FKBP4
(Homo sapiens (Human)) | BDBM50388294
(CHEMBL2058790)Show SMILES COc1ccc(OCCOC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cc(Cl)cc(Cl)c2)cc1OC |r| Show InChI InChI=1S/C22H25Cl2NO7S/c1-29-20-7-6-17(14-21(20)30-2)31-9-10-32-22(26)19-5-3-4-8-25(19)33(27,28)18-12-15(23)11-16(24)13-18/h6-7,11-14,19H,3-5,8-10H2,1-2H3/t19-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Max Planck Institute of Psychiatry
Curated by ChEMBL
| Assay Description Binding affinity to FKBP52 FK1 domain by competitive fluorescence polarization assay |
J Med Chem 55: 4123-31 (2012)
Article DOI: 10.1021/jm201747c BindingDB Entry DOI: 10.7270/Q2QJ7JCV |
More data for this Ligand-Target Pair | |
Peptidyl-prolyl cis-trans isomerase FKBP1A
(Homo sapiens (Human)) | BDBM50388294
(CHEMBL2058790)Show SMILES COc1ccc(OCCOC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cc(Cl)cc(Cl)c2)cc1OC |r| Show InChI InChI=1S/C22H25Cl2NO7S/c1-29-20-7-6-17(14-21(20)30-2)31-9-10-32-22(26)19-5-3-4-8-25(19)33(27,28)18-12-15(23)11-16(24)13-18/h6-7,11-14,19H,3-5,8-10H2,1-2H3/t19-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Max Planck Institute of Psychiatry
Curated by ChEMBL
| Assay Description Binding affinity to FKBP12 by competitive fluorescence polarization assay |
J Med Chem 55: 4123-31 (2012)
Article DOI: 10.1021/jm201747c BindingDB Entry DOI: 10.7270/Q2QJ7JCV |
More data for this Ligand-Target Pair | |
Peptidyl-prolyl cis-trans isomerase FKBP5
(Homo sapiens (Human)) | BDBM50388294
(CHEMBL2058790)Show SMILES COc1ccc(OCCOC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cc(Cl)cc(Cl)c2)cc1OC |r| Show InChI InChI=1S/C22H25Cl2NO7S/c1-29-20-7-6-17(14-21(20)30-2)31-9-10-32-22(26)19-5-3-4-8-25(19)33(27,28)18-12-15(23)11-16(24)13-18/h6-7,11-14,19H,3-5,8-10H2,1-2H3/t19-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Max Planck Institute of Psychiatry
Curated by ChEMBL
| Assay Description Binding affinity to FKBP51 FK1 domain by competitive fluorescence polarization assay |
J Med Chem 55: 4123-31 (2012)
Article DOI: 10.1021/jm201747c BindingDB Entry DOI: 10.7270/Q2QJ7JCV |
More data for this Ligand-Target Pair | |