BDBM15788 4-[(4-fluorophenyl)methyl]piperidine::CHEMBL1204355::CHEMBL144527::fragment 4::piperidine 4
SMILES: Fc1ccc(CC2CCNCC2)cc1
InChI Key: InChIKey=JLAKCHGEEBPDQI-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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Serotonin 2 (5-HT2) receptor (Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...) | BDBM15788![]() (4-[(4-fluorophenyl)methyl]piperidine | CHEMBL12043...) | PDB Reactome pathway UniProtKB/SwissProt GoogleScholar | Purchase CHEMBL DrugBank PC cid PC sid PDB UniChem Patents Similars | Article PubMed | 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University Curated by ChEMBL | Assay Description Binding affinity against 5-Hydroxy tryptamine 2 (5-hydroxytryptamine 2)receptor | J Med Chem 35: 4903-10 (1993) Article DOI: 10.1021/jm00104a017 BindingDB Entry DOI: 10.7270/Q26T0N86 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serotonin receptor 2a and 2c (5HT2A and 5HT2C) (Rattus norvegicus (Rat)) | BDBM15788![]() (4-[(4-fluorophenyl)methyl]piperidine | CHEMBL12043...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar | Purchase CHEMBL DrugBank PC cid PC sid PDB UniChem Patents Similars | Article PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University Curated by ChEMBL | Assay Description Binding affinity against 5-hydroxytryptamine 1C receptor | J Med Chem 35: 4903-10 (1993) Article DOI: 10.1021/jm00104a017 BindingDB Entry DOI: 10.7270/Q26T0N86 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Beta-secretase 1 (Homo sapiens (Human)) | BDBM15788![]() (4-[(4-fluorophenyl)methyl]piperidine | CHEMBL12043...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar | Purchase CHEMBL DrugBank PC cid PC sid PDB UniChem Patents Similars | PDB Article PubMed | n/a | n/a | n/a | n/a | n/a | n/a | n/a | 5.0 | 22 |
Astex | Assay Description Activity of BACE-1 was measured by monitoring the cleavage of its peptide substrate on a Fluoroskan Ascent plate reader with excitation and emission ... | J Med Chem 50: 1116-23 (2007) Article DOI: 10.1021/jm0611962 BindingDB Entry DOI: 10.7270/Q2Q23XHV | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) |