null

SMILES: COc1ccccc1N1CCN(CCCCNC(=O)c2cccc(F)n2)CC1

InChI Key: InChIKey=VQBXPTGVNAAIHI-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50172866   

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 1A (Homo sapiens (Human))	BDBM50172866 (6-Fluoro-pyridine-2-carboxylic acid {4-[4-(2-metho...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cccc(F)n2)CC1 Show InChI InChI=1S/C21H27FN4O2/c1-28-19-9-3-2-8-18(19)26-15-13-25(14-16-26)12-5-4-11-23-21(27)17-7-6-10-20(22)24-17/h2-3,6-10H,4-5,11-16H2,1H3,(H,23,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards 5-HT1A receptor using porcine cortical membraneand [3H]-8-OH-DPAT as radioligand				Bioorg Med Chem Lett 15: 4819-23 (2005) Article DOI: 10.1016/j.bmcl.2005.07.037 BindingDB Entry DOI: 10.7270/Q2Z60NM9
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50172866 (6-Fluoro-pyridine-2-carboxylic acid {4-[4-(2-metho...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cccc(F)n2)CC1 Show InChI InChI=1S/C21H27FN4O2/c1-28-19-9-3-2-8-18(19)26-15-13-25(14-16-26)12-5-4-11-23-21(27)17-7-6-10-20(22)24-17/h2-3,6-10H,4-5,11-16H2,1H3,(H,23,27)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	76	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards Dopamine receptor D 4.4 using CHO cell line and [3H]-spiperone as radioligand				Bioorg Med Chem Lett 15: 4819-23 (2005) Article DOI: 10.1016/j.bmcl.2005.07.037 BindingDB Entry DOI: 10.7270/Q2Z60NM9
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50172866 (6-Fluoro-pyridine-2-carboxylic acid {4-[4-(2-metho...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cccc(F)n2)CC1 Show InChI InChI=1S/C21H27FN4O2/c1-28-19-9-3-2-8-18(19)26-15-13-25(14-16-26)12-5-4-11-23-21(27)17-7-6-10-20(22)24-17/h2-3,6-10H,4-5,11-16H2,1H3,(H,23,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	86	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards Dopamine receptor D3 using CHO cell line and [3H]-spiperone as radioligand				Bioorg Med Chem Lett 15: 4819-23 (2005) Article DOI: 10.1016/j.bmcl.2005.07.037 BindingDB Entry DOI: 10.7270/Q2Z60NM9
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50172866 (6-Fluoro-pyridine-2-carboxylic acid {4-[4-(2-metho...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cccc(F)n2)CC1 Show InChI InChI=1S/C21H27FN4O2/c1-28-19-9-3-2-8-18(19)26-15-13-25(14-16-26)12-5-4-11-23-21(27)17-7-6-10-20(22)24-17/h2-3,6-10H,4-5,11-16H2,1H3,(H,23,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	260	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards Dopamine D2L receptor using CHO cell line and [3H]-spiperone as radioligand				Bioorg Med Chem Lett 15: 4819-23 (2005) Article DOI: 10.1016/j.bmcl.2005.07.037 BindingDB Entry DOI: 10.7270/Q2Z60NM9
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50172866 (6-Fluoro-pyridine-2-carboxylic acid {4-[4-(2-metho...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cccc(F)n2)CC1 Show InChI InChI=1S/C21H27FN4O2/c1-28-19-9-3-2-8-18(19)26-15-13-25(14-16-26)12-5-4-11-23-21(27)17-7-6-10-20(22)24-17/h2-3,6-10H,4-5,11-16H2,1H3,(H,23,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards Dopamine D2S receptor using CHO cell line and [3H]-spiperone as radioligand				Bioorg Med Chem Lett 15: 4819-23 (2005) Article DOI: 10.1016/j.bmcl.2005.07.037 BindingDB Entry DOI: 10.7270/Q2Z60NM9
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Sus scrofa)	BDBM50172866 (6-Fluoro-pyridine-2-carboxylic acid {4-[4-(2-metho...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2cccc(F)n2)CC1 Show InChI InChI=1S/C21H27FN4O2/c1-28-19-9-3-2-8-18(19)26-15-13-25(14-16-26)12-5-4-11-23-21(27)17-7-6-10-20(22)24-17/h2-3,6-10H,4-5,11-16H2,1H3,(H,23,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Erlangen-Nuremberg Curated by ChEMBL					Assay Description Binding affinity towards Dopamine receptor D1 using porcine striatal membrane and [3H]-SCH- 23390 as radioligand				Bioorg Med Chem Lett 15: 4819-23 (2005) Article DOI: 10.1016/j.bmcl.2005.07.037 BindingDB Entry DOI: 10.7270/Q2Z60NM9
					More data for this Ligand-Target Pair