BDBM50039757 CHEMBL92682::Trifluoro-methanesulfonic acid 3-propyl-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]indol-6-yl ester
SMILES: CCCN1CCC2C1CCc1c(OS(=O)(=O)C(F)(F)F)cccc21
InChI Key: InChIKey=ASMVKSNPCVNVFO-UHFFFAOYSA-N
Data: 4 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 |
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D(3) dopamine receptor (Homo sapiens (Human)) | BDBM50039757![]() (CHEMBL92682 | Trifluoro-methanesulfonic acid 3-pro...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | PubMed | 61 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of G£teborg Curated by ChEMBL | Assay Description Tested for in vitro binding affinity against cloned mammalian dopamine autoreceptor (DA) receptors expressed in CHO-K1 cells [3H]-spiperone as radiol... | J Med Chem 37: 2735-53 (1994) BindingDB Entry DOI: 10.7270/Q2J96719 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat)) | BDBM50039757![]() (CHEMBL92682 | Trifluoro-methanesulfonic acid 3-pro...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | PubMed | 72 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of G£teborg Curated by ChEMBL | Assay Description Tested for affinity against 5-hydroxytryptamine 1A receptor using [3H]8-OH-DPAT in homogenized rat brain tissue | J Med Chem 37: 2735-53 (1994) BindingDB Entry DOI: 10.7270/Q2J96719 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(2) dopamine receptor (Rattus norvegicus (rat)) | BDBM50039757![]() (CHEMBL92682 | Trifluoro-methanesulfonic acid 3-pro...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | PubMed | 82 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of G£teborg Curated by ChEMBL | Assay Description Tested for affinity against striatal dopamine autoreceptor (DA) D2 receptors using [3H]spiperone as raidoligand in rats. | J Med Chem 37: 2735-53 (1994) BindingDB Entry DOI: 10.7270/Q2J96719 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(2) dopamine receptor (Homo sapiens (Human)) | BDBM50039757![]() (CHEMBL92682 | Trifluoro-methanesulfonic acid 3-pro...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | PubMed | >217 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of G£teborg Curated by ChEMBL | Assay Description Affinity against recombinant dopamine receptor (DA) D2 expressed in CHO-K1 cells, using [3H]-spiperone as radioligand | J Med Chem 37: 2735-53 (1994) BindingDB Entry DOI: 10.7270/Q2J96719 | |||||||||||
More data for this Ligand-Target Pair |