BDBM50122243 4-Chloro-5-[4-(furan-2-carbonyl)-piperazin-1-yl]-2-{7-[4-(2-isopropoxy-phenyl)-piperazin-1-yl]-heptyl}-2H-pyridazin-3-one::4-chloro-5-(4-(furan-2-carbonyl)piperazin-1-yl)-2-(7-(4-(2-isopropoxyphenyl)piperazin-1-yl)heptyl)pyridazin-3(2H)-one::CHEMBL47792
SMILES: CC(C)Oc1ccccc1N1CCN(CCCCCCCn2ncc(N3CCN(CC3)C(=O)c3ccco3)c(Cl)c2=O)CC1
InChI Key: InChIKey=AMSRQIGFIHJSPY-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat)) | BDBM50122243 (4-Chloro-5-[4-(furan-2-carbonyl)-piperazin-1-yl]-2...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.0520 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Pisa Curated by ChEMBL | Assay Description Binding affinity towards Alpha-1 adrenergic receptor in rat cerebral cortex using [3H]prazosin | Bioorg Med Chem Lett 13: 171-3 (2002) BindingDB Entry DOI: 10.7270/Q2TM79GX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor (RAT-NEONATAL RAT-Rattus norvegicus (rat)) | BDBM50122243 (4-Chloro-5-[4-(furan-2-carbonyl)-piperazin-1-yl]-2...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.560 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Pisa Curated by ChEMBL | Assay Description Inhibitory concentration against alphaV-beta3 integrin using vitronectin ELISA assay. | Bioorg Med Chem Lett 13: 171-3 (2002) BindingDB Entry DOI: 10.7270/Q2TM79GX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat)) | BDBM50122243 (4-Chloro-5-[4-(furan-2-carbonyl)-piperazin-1-yl]-2...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Pisa Curated by ChEMBL | Assay Description Binding affinity towards 5-hydroxytryptamine 1A receptor receptor in rat cerebral cortex using [3H]-8-OH-DPAT | Bioorg Med Chem Lett 13: 171-3 (2002) BindingDB Entry DOI: 10.7270/Q2TM79GX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat)) | BDBM50122243 (4-Chloro-5-[4-(furan-2-carbonyl)-piperazin-1-yl]-2...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Pisa Curated by ChEMBL | Assay Description Displacement of [3H]-8-OH-DPAT from 5-hydroxytryptamine 1A receptor of rat cortex membranes | J Med Chem 46: 3555-8 (2003) Article DOI: 10.1021/jm0307842 BindingDB Entry DOI: 10.7270/Q2VX0FWQ | |||||||||||
More data for this Ligand-Target Pair |