BDBM50033445 6-[3-(2-Amino-ethyl)-1H-indol-5-yloxy]-1-[4-(4-nitro-phenyl)-piperazin-1-yl]-hexan-1-one::CHEMBL121207
SMILES: NCCc1c[nH]c2ccc(OCCCCCC(=O)N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)cc12
InChI Key: InChIKey=RGPLSFRRJSKYHV-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
5-hydroxytryptamine receptor 1D (Homo sapiens (Human)) | BDBM50033445 (6-[3-(2-Amino-ethyl)-1H-indol-5-yloxy]-1-[4-(4-nit...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.340 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Centre de Recherche Pierre Fabre Curated by ChEMBL | Assay Description Binding affinity to recombinant human 5-hydroxytryptamine 1D receptor alpha | J Med Chem 38: 3602-7 (1995) BindingDB Entry DOI: 10.7270/Q25M66C2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1D (Homo sapiens (Human)) | BDBM50033445 (6-[3-(2-Amino-ethyl)-1H-indol-5-yloxy]-1-[4-(4-nit...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.470 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Centre de Recherche Pierre Fabre Curated by ChEMBL | Assay Description Binding affinity for cloned human 5-hydroxytryptamine 1D receptor beta | J Med Chem 38: 3602-7 (1995) BindingDB Entry DOI: 10.7270/Q25M66C2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1A (Homo sapiens (Human)) | BDBM50033445 (6-[3-(2-Amino-ethyl)-1H-indol-5-yloxy]-1-[4-(4-nit...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Centre de Recherche Pierre Fabre Curated by ChEMBL | Assay Description Binding affinity for cloned human 5-hydroxytryptamine 1A receptor | J Med Chem 38: 3602-7 (1995) BindingDB Entry DOI: 10.7270/Q25M66C2 | |||||||||||
More data for this Ligand-Target Pair |