BDBM50099891 3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmethyl]-1H-pyrrolo[2,3-b]pyridine::CHEMBL283036
SMILES: FC(F)(F)c1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
InChI Key: InChIKey=BFQIOOYNLCWKIJ-UHFFFAOYSA-N
Data: 23 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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Dopamine receptor (RAT) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 34 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description In vitro binding affinity to rat Dopamine receptor D4 measured by displacement of the radioligand [3H]-spiperone | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 7 (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 318 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description In vitro binding affinity to human 5-hydroxytryptamine 7 receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 2A (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 2.79E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned human 5-hydroxytryptamine 2A receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 6 (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | 7.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description In vitro binding affinity to human 5-hydroxytryptamine 6 receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serotonin (5-HT) receptor (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned human 5-hydroxytryptamine 1E receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned Muscarinic acetylcholine receptor M2 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Histamine H1 receptor (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned Histamine H1 receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 2C (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned human 5-hydroxytryptamine 2C receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 5A (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned human 5-hydroxytryptamine 5A receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Kappa-type opioid receptor (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity of the compound to cloned Opioid receptor kappa 1 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(2) dopamine receptor (Rattus norvegicus (rat)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description In vitro binding affinity to rat Dopamine receptor D2 measured by displacement of the radioligand [3H]-spiperone | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned Muscarinic acetylcholine receptor M1 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1D (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned human 5-hydroxytryptamine 1D receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned Opioid receptor mu 1 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1A (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description In vitro binding affinity to human 5-hydroxytryptamine 1A receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Muscarinic acetylcholine receptor M5 (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned Muscarinic acetylcholine receptor M5 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned Muscarinic acetylcholine receptor M3 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dopamine D1B (RAT) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description In vitro binding affinity to cloned rat D5 receptor measured by displacement of radioligand [3H]-SCH-23,982 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(3) dopamine receptor (Rattus norvegicus (Rat)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description In vitro binding affinity to cloned rat Dopamine receptor D3 measured by displacement of the radioligand [3H]-sulpiride | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(1A) dopamine receptor (RAT) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description In vitro binding affinity to cloned rat Dopamine receptor D1 measured by displacement of radioligand [3H]-SCH-23,982 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1B (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned human 5-hydroxytryptamine 1B receptor | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Delta-type opioid receptor (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned Opioid receptor delta 1 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Muscarinic acetylcholine receptor M4 (Homo sapiens (Human)) | BDBM50099891 (3-[4-(4-Trifluoromethyl-phenyl)-piperazin-1-ylmeth...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Columbia University College of Physicians and Surgeons Curated by ChEMBL | Assay Description Binding affinity to cloned Muscarinic acetylcholine receptor M4 | Bioorg Med Chem Lett 11: 1375-7 (2001) BindingDB Entry DOI: 10.7270/Q28C9VHC | |||||||||||
More data for this Ligand-Target Pair |