BDBM84203 4-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]benzoic acid ethyl ester::4-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzoic acid ethyl ester::MLS000044008::SMR000021419::cid_1267856::ethyl 4-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]benzoate::ethyl 4-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzoate::ethyl 4-{[(5-phenyl-2H-tetrazol-2-yl)acetyl]amino}benzoate
SMILES: CCOC(=O)c1ccc(NC(=O)Cn2nnc(n2)-c2ccccc2)cc1
InChI Key: InChIKey=VWNALFAWLZSMNH-UHFFFAOYSA-N
Data: 3 EC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Beta-2 adrenergic receptor (Homo sapiens (Human)) | BDBM84203 (4-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]ben...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 1.18E+3 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: R03 MH093192-01 Project Title: HTS for Non-Canonical Ligands for Beta 2 Adrenergic Receptor... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2RB734K | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
CCR5 (Homo sapiens (Human)) | BDBM84203 (4-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]ben...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 123 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q23B5XSC | ||||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Beta-2 adrenergic receptor (Homo sapiens (Human)) | BDBM84203 (4-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]ben...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 1.31E+3 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: R03 MH093192-01 Project Title: HTS for Non-Canonical Ligands for Beta 2 Adrenergic Receptor... | PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2R49PB0 | |||||||||||
More data for this Ligand-Target Pair |