BDBM50200322 2beta-carbomethoxy-3beta-(3'-((Z)-2-iodoethenyl)phenyl)nortropane::CHEMBL216736
SMILES: COC(=O)[C@@H]1C2CCC(C[C@@H]1c1cccc(\C=C\I)c1)N2
InChI Key: InChIKey=AHEMMEONOCHONP-DBUDALRPSA-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)) | BDBM50200322 (2beta-carbomethoxy-3beta-(3'-((Z)-2-iodoethenyl)ph...) | PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Curated by ChEMBL | Assay Description Displacement of [3H]citalopram from human SERT | J Med Chem 49: 6760-7 (2006) Article DOI: 10.1021/jm060641q BindingDB Entry DOI: 10.7270/Q218365J | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent dopamine transporter (Homo sapiens (Human)) | BDBM50200322 (2beta-carbomethoxy-3beta-(3'-((Z)-2-iodoethenyl)ph...) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 29.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Curated by ChEMBL | Assay Description Displacement of [3H]RTI-55 from human DAT | J Med Chem 49: 6760-7 (2006) Article DOI: 10.1021/jm060641q BindingDB Entry DOI: 10.7270/Q218365J | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent noradrenaline transporter (Homo sapiens (Human)) | BDBM50200322 (2beta-carbomethoxy-3beta-(3'-((Z)-2-iodoethenyl)ph...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 102 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Curated by ChEMBL | Assay Description Displacement of [3H]nisoxetine from human NET | J Med Chem 49: 6760-7 (2006) Article DOI: 10.1021/jm060641q BindingDB Entry DOI: 10.7270/Q218365J | |||||||||||
More data for this Ligand-Target Pair |