BDBM50211037 CHEMBL398009::methyl 2-(4-chlorophenyl)cyclohept-1-enecarboxylate
SMILES: COC(=O)C1=C(CCCCC1)c1ccc(Cl)cc1
InChI Key: InChIKey=KLBBBQNCHMPXRI-UHFFFAOYSA-N
Data: 5 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 dopamine transporter (Homo sapiens (Human)) | BDBM50211037 (CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Aarhus Curated by ChEMBL | Assay Description Inhibition of [3H]DA uptake in 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 | |||||||||||||
Sodium-dependent dopamine transporter (Homo sapiens (Human)) | BDBM50211037 (CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...) | NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.50E+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 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 | |||||||||||||
Sodium-dependent noradrenaline transporter (Homo sapiens (Human)) | BDBM50211037 (CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 2.00E+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 Inhibition of [3H]DA uptake in 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 noradrenaline transporter (Homo sapiens (Human)) | BDBM50211037 (CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 8.40E+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 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 serotonin transporter (Homo sapiens (Human)) | BDBM50211037 (CHEMBL398009 | methyl 2-(4-chlorophenyl)cyclohept-...) | PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 7.06E+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 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 |