BDBM50002227 2-(4-Fluoro-phenyl)-1-(1-pyridin-4-ylmethyl-piperidin-4-yl)-ethanone; compound with dibut-2-enedioic acid;0.75hydrate::CHEMBL337124
SMILES: Fc1ccc(CC(=O)C2CCN(Cc3ccncc3)CC2)cc1
InChI Key: InChIKey=OIOZNWCZHDMAHS-UHFFFAOYSA-N
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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Sigma non-opioid intracellular receptor 1 (Mus musculus (Mouse)) | BDBM50002227 (2-(4-Fluoro-phenyl)-1-(1-pyridin-4-ylmethyl-piperi...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Du Pont Merck Pharmaceutical Company Curated by ChEMBL | Assay Description In vitro binding affinity for the mouse sigma opioid receptor | J Med Chem 35: 4344-61 (1992) BindingDB Entry DOI: 10.7270/Q28P614G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serotonin 2 (5-HT2) receptor (Mus musculus (Mouse)) | BDBM50002227 (2-(4-Fluoro-phenyl)-1-(1-pyridin-4-ylmethyl-piperi...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Du Pont Merck Pharmaceutical Company Curated by ChEMBL | Assay Description In vitro binding affinity for serotonin 5-hydroxytryptamine (5-HT) 2 receptors | J Med Chem 35: 4344-61 (1992) BindingDB Entry DOI: 10.7270/Q28P614G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(2) dopamine receptor (Mus musculus (Mouse)) | BDBM50002227 (2-(4-Fluoro-phenyl)-1-(1-pyridin-4-ylmethyl-piperi...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Du Pont Merck Pharmaceutical Company Curated by ChEMBL | Assay Description In vitro binding affinity towards dopamine receptor D2 | J Med Chem 35: 4344-61 (1992) BindingDB Entry DOI: 10.7270/Q28P614G | |||||||||||
More data for this Ligand-Target Pair |