BDBM50211016 CHEMBL232879::methyl 2-phenylcyclohex-1-enecarboxylate
SMILES: COC(=O)C1=C(CCCC1)c1cccc(c1)[N+]([O-])=O
InChI Key: InChIKey=LQZNMKWOFOJVOS-UHFFFAOYSA-N
Data: 3 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sodium-dependent serotonin transporter (Homo sapiens (Human)) | BDBM50211016 (CHEMBL232879 | methyl 2-phenylcyclohex-1-enecarbox...) | PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 2.87E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus Curated by ChEMBL | Assay Description Displacement of [125I]RTI55 from human SERT expressed in COS1 cell membrane | Bioorg Med Chem 15: 4159-74 (2007) Article DOI: 10.1016/j.bmc.2007.03.069 BindingDB Entry DOI: 10.7270/Q2ZC83PB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent noradrenaline transporter (Homo sapiens (Human)) | BDBM50211016 (CHEMBL232879 | methyl 2-phenylcyclohex-1-enecarbox...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 1.21E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus Curated by ChEMBL | Assay Description Displacement of [125I]RTI55 from human NET expressed in COS1 cell membrane | Bioorg Med Chem 15: 4159-74 (2007) Article DOI: 10.1016/j.bmc.2007.03.069 BindingDB Entry DOI: 10.7270/Q2ZC83PB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent dopamine transporter (Homo sapiens (Human)) | BDBM50211016 (CHEMBL232879 | methyl 2-phenylcyclohex-1-enecarbox...) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 2.39E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus Curated by ChEMBL | Assay Description Displacement of [125I]RTI55 from human DAT expressed in COS1 cell membrane | Bioorg Med Chem 15: 4159-74 (2007) Article DOI: 10.1016/j.bmc.2007.03.069 BindingDB Entry DOI: 10.7270/Q2ZC83PB | |||||||||||
More data for this Ligand-Target Pair |