BDBM50091096 5-Chloro-2-(2-dimethylaminomethyl-phenylsulfanyl)-phenylamine::CHEMBL432394
SMILES: CN(C)Cc1ccccc1Sc1ccc(Cl)cc1N
InChI Key: InChIKey=GAZPWELASOLBPG-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)) | BDBM50091096 (5-Chloro-2-(2-dimethylaminomethyl-phenylsulfanyl)-...) | PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.270 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Centre for Addiction and Mental Health Curated by ChEMBL | Assay Description In vitro binding affinity on cloned Serotonin transporter | J Med Chem 43: 3103-10 (2000) BindingDB Entry DOI: 10.7270/Q2J67G4W | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent dopamine transporter (Homo sapiens (Human)) | BDBM50091096 (5-Chloro-2-(2-dimethylaminomethyl-phenylsulfanyl)-...) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 115 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Centre for Addiction and Mental Health Curated by ChEMBL | Assay Description In vitro binding affinity on cloned Dopamine transporter | J Med Chem 43: 3103-10 (2000) BindingDB Entry DOI: 10.7270/Q2J67G4W | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent noradrenaline transporter (Homo sapiens (Human)) | BDBM50091096 (5-Chloro-2-(2-dimethylaminomethyl-phenylsulfanyl)-...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 230 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Centre for Addiction and Mental Health Curated by ChEMBL | Assay Description In vitro binding affinity on cloned Norepinephrine transporter | J Med Chem 43: 3103-10 (2000) BindingDB Entry DOI: 10.7270/Q2J67G4W | |||||||||||
More data for this Ligand-Target Pair |