BDBM41638 3-(3-Methyl-benzoylamino)-9-aza-bicyclo[3.3.1]nonane-9-carboxylic acid cyclohexylamide::MLS000074250::N-cyclohexyl-3-(m-toluoylamino)-9-azabicyclo[3.3.1]nonane-9-carboxamide::N-cyclohexyl-3-[(3-methylbenzoyl)amino]-9-azabicyclo[3.3.1]nonane-9-carboxamide::N-cyclohexyl-3-[(3-methylphenyl)carbonylamino]-9-azabicyclo[3.3.1]nonane-9-carboxamide::N-cyclohexyl-3-[[(3-methylphenyl)-oxomethyl]amino]-9-azabicyclo[3.3.1]nonane-9-carboxamide::SMR000006243::cid_647078
SMILES: [H]C12CCCC([H])(CC(C1)NC(=O)c1cccc(C)c1)N2C(=O)NC1CCCCC1
InChI Key: InChIKey=UAUHAXQFAHPNTI-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sphingosine 1-phosphate receptor 2 (Homo sapiens (Human)) | BDBM41638 (3-(3-Methyl-benzoylamino)-9-aza-bicyclo[3.3.1]nona...) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2902257 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sphingosine 1-phosphate receptor 2 (Homo sapiens (Human)) | BDBM41638 (3-(3-Methyl-benzoylamino)-9-aza-bicyclo[3.3.1]nona...) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q26D5RD0 | |||||||||||
More data for this Ligand-Target Pair |