BDBM18833 4-propylphenyl prop-2-enoate::Substituted Acrylate, 6a
SMILES: CCCc1ccc(OC(=O)C=C)cc1
InChI Key: InChIKey=UCAXSSLSIVOWFR-UHFFFAOYSA-N
Data: 2 IC50
PDB links: 1 PDB ID contains this monomer as substructures. 1 PDB ID contains inhibitors having a similarity of 90% to this monomer.
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Thyroid Hormone Receptor (TR-beta) (Homo sapiens (Human)) | BDBM18833 (4-propylphenyl prop-2-enoate | Substituted Acrylat...) | PDB MMDB B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
St. Jude Research Hospital | Assay Description IC50 is the concentration of each compound required to inhibit 50% of the binding between the TR LBD and the SRC2-2 peptide using fluorescence polari... | J Med Chem 50: 5269-5280 (2007) Article DOI: 10.1021/jm070556y BindingDB Entry DOI: 10.7270/Q24B2ZK8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Thyroid Hormone Receptor (TR-alpha) (Homo sapiens (Human)) | BDBM18833 (4-propylphenyl prop-2-enoate | Substituted Acrylat...) | PDB MMDB B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | 7.2 | 22 |
St. Jude Research Hospital | Assay Description IC50 is the concentration of each compound required to inhibit 50% of the binding between the TR LBD and the SRC2-2 peptide using fluorescence polari... | J Med Chem 50: 5269-5280 (2007) Article DOI: 10.1021/jm070556y BindingDB Entry DOI: 10.7270/Q24B2ZK8 | |||||||||||
More data for this Ligand-Target Pair |