BDBM50269979 CHEMBL515170::r-5-(2-E-cyclopropylvinyl)-t-3-ethyl-6,7-difluoro-5-(trifluoromethyl)benzo[e][1,4]-oxazepin-2(1H,3H,5H)-one
SMILES: CC[C@@H]1O[C@@](\C=C\C2CC2)(c2c(F)c(F)ccc2NC1=O)C(F)(F)F
InChI Key: InChIKey=MSJCAWWJIHDUAU-OSTNNTLRSA-N
Data: 7 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Parathyroid hormone receptor (Homo sapiens (Human)) | BDBM50269979 (CHEMBL515170 | r-5-(2-E-cyclopropylvinyl)-t-3-ethy...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmaceutical Research Institute Curated by ChEMBL | Assay Description Antagonist activity at PTH/PTH-related peptide receptor (unknown origin) expressed in HKRK-B28 cells assessed as inhibition of parathyroid hormone (1... | Proc Natl Acad Sci U S A 104: 6846-51 (2007) Article DOI: 10.1073/pnas.0605125104 BindingDB Entry DOI: 10.7270/Q28P608V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 2A (Homo sapiens (Human)) | BDBM50269979 (CHEMBL515170 | r-5-(2-E-cyclopropylvinyl)-t-3-ethy...) | 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 | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmaceutical Research Institute Curated by ChEMBL | Assay Description Inhibition of 5HT2A receptor (unknown origin) | Proc Natl Acad Sci U S A 104: 6846-51 (2007) Article DOI: 10.1073/pnas.0605125104 BindingDB Entry DOI: 10.7270/Q28P608V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Alpha-1D adrenergic receptor (Homo sapiens (Human)) | BDBM50269979 (CHEMBL515170 | r-5-(2-E-cyclopropylvinyl)-t-3-ethy...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmaceutical Research Institute Curated by ChEMBL | Assay Description Inhibition of adrenergic alpha1D receptor (unknown origin) | Proc Natl Acad Sci U S A 104: 6846-51 (2007) Article DOI: 10.1073/pnas.0605125104 BindingDB Entry DOI: 10.7270/Q28P608V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Parathyroid hormone receptor (Homo sapiens (Human)) | BDBM50269979 (CHEMBL515170 | r-5-(2-E-cyclopropylvinyl)-t-3-ethy...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 990 | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmaceutical Research Institute Curated by ChEMBL | Assay Description Displacement of [125I]DPC-AJ1951 from PTH/PTH-related peptide receptor (unknown origin) expressed in HKRK-B28 cells | Proc Natl Acad Sci U S A 104: 6846-51 (2007) Article DOI: 10.1073/pnas.0605125104 BindingDB Entry DOI: 10.7270/Q28P608V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Alpha-2C adrenergic receptor (Homo sapiens (Human)) | BDBM50269979 (CHEMBL515170 | r-5-(2-E-cyclopropylvinyl)-t-3-ethy...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.04E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmaceutical Research Institute Curated by ChEMBL | Assay Description Inhibition of adrenergic alpha2C receptor (unknown origin) | Proc Natl Acad Sci U S A 104: 6846-51 (2007) Article DOI: 10.1073/pnas.0605125104 BindingDB Entry DOI: 10.7270/Q28P608V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Parathyroid hormone receptor (Homo sapiens (Human)) | BDBM50269979 (CHEMBL515170 | r-5-(2-E-cyclopropylvinyl)-t-3-ethy...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 5.78E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmaceutical Research Institute Curated by ChEMBL | Assay Description Antagonist activity at PTH/PTH-related peptide receptor (unknown origin) expressed in HKRK-B28 cells assessed as inhibition of DPC-AJ1951-induced cAM... | Proc Natl Acad Sci U S A 104: 6846-51 (2007) Article DOI: 10.1073/pnas.0605125104 BindingDB Entry DOI: 10.7270/Q28P608V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Neurokinin 2 receptor (Homo sapiens (Human)) | BDBM50269979 (CHEMBL515170 | r-5-(2-E-cyclopropylvinyl)-t-3-ethy...) | Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmaceutical Research Institute Curated by ChEMBL | Assay Description Inhibition of neurokinin 2 receptor (unknown origin) | Proc Natl Acad Sci U S A 104: 6846-51 (2007) Article DOI: 10.1073/pnas.0605125104 BindingDB Entry DOI: 10.7270/Q28P608V | |||||||||||
More data for this Ligand-Target Pair |