BDBM50305285 CHEMBL595262::[(1R,2R,6R,10S,11R,13S,15R,17R)-13-benzyl-6-hydroxy-4,17-dimethyl-5-oxo-15-(prop-1-en-2-yl)-12,14,18-trioxapentacyclo[11.4.1.0^{1,10}.0^{2,6}.0^{11,15}]octadeca-3,8-dien-8-yl]methyl (4-hydroxy-3-iodo-5-methoxyphenyl) carbonate
SMILES: COc1cc(OC(=O)OCC2=C[C@H]3[C@H]4O[C@]5(Cc6ccccc6)O[C@]4(C[C@@H](C)[C@]3(O5)[C@@H]3C=C(C)C(=O)[C@@]3(O)C2)C(C)=C)cc(I)c1O
InChI Key: InChIKey=WCPKEBYJPDOASM-GGBXHWPASA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Vanilloid receptor (Rattus norvegicus (rat)) | BDBM50305285 (CHEMBL595262 | [(1R,2R,6R,10S,11R,13S,15R,17R)-13-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Seoul National University Curated by ChEMBL | Assay Description Displacement of [3H]RTX from rat TRPV1 expressed in CHO cells | Eur J Med Chem 68: 233-43 (2013) Article DOI: 10.1016/j.ejmech.2013.07.042 BindingDB Entry DOI: 10.7270/Q2RB761G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Vanilloid receptor (Rattus norvegicus (rat)) | BDBM50305285 (CHEMBL595262 | [(1R,2R,6R,10S,11R,13S,15R,17R)-13-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Seoul National University Curated by ChEMBL | Assay Description Antagonist activity at rat TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-stimulated Ca2+ uptake | Eur J Med Chem 68: 233-43 (2013) Article DOI: 10.1016/j.ejmech.2013.07.042 BindingDB Entry DOI: 10.7270/Q2RB761G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human)) | BDBM50305285 (CHEMBL595262 | [(1R,2R,6R,10S,11R,13S,15R,17R)-13-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 49 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Seoul National University Curated by ChEMBL | Assay Description Displacement of [3H]RTX from human TRPV1 expressed in CHO cells | Eur J Med Chem 68: 233-43 (2013) Article DOI: 10.1016/j.ejmech.2013.07.042 BindingDB Entry DOI: 10.7270/Q2RB761G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human)) | BDBM50305285 (CHEMBL595262 | [(1R,2R,6R,10S,11R,13S,15R,17R)-13-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 189 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Seoul National University Curated by ChEMBL | Assay Description Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-stimulated Ca2+ uptake | Eur J Med Chem 68: 233-43 (2013) Article DOI: 10.1016/j.ejmech.2013.07.042 BindingDB Entry DOI: 10.7270/Q2RB761G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human)) | BDBM50305285 (CHEMBL595262 | [(1R,2R,6R,10S,11R,13S,15R,17R)-13-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | n/a | 4.70 | n/a | n/a | n/a | n/a |
Universit£ del Piemonte Orientale Curated by ChEMBL | Assay Description Agonist activity at human TRPV1 expressed in HEK293 cells assessed as increase in intracellular calcium level | Bioorg Med Chem Lett 20: 97-9 (2010) Article DOI: 10.1016/j.bmcl.2009.11.035 BindingDB Entry DOI: 10.7270/Q2W37X84 | |||||||||||
More data for this Ligand-Target Pair |