null

SMILES: COc1c(Cl)ccc2N=C(NCC(F)F)NC(C)c12

InChI Key: InChIKey=PZVDYPMNMHJRDU-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50371983   

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 7 (Homo sapiens (Human))	BDBM50371983 (CHEMBL257744) Show SMILES COc1c(Cl)ccc2N=C(NCC(F)F)NC(C)c12 |t:8| Show InChI InChI=1S/C12H14ClF2N3O/c1-6-10-8(4-3-7(13)11(10)19-2)18-12(17-6)16-5-9(14)15/h3-4,6,9H,5H2,1-2H3,(H2,16,17,18)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to human 5HT7 receptor				Bioorg Med Chem Lett 18: 262-6 (2008) Article DOI: 10.1016/j.bmcl.2007.10.078 BindingDB Entry DOI: 10.7270/Q2FJ2HNN
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 5A (Homo sapiens (Human))	BDBM50371983 (CHEMBL257744) Show SMILES COc1c(Cl)ccc2N=C(NCC(F)F)NC(C)c12 |t:8| Show InChI InChI=1S/C12H14ClF2N3O/c1-6-10-8(4-3-7(13)11(10)19-2)18-12(17-6)16-5-9(14)15/h3-4,6,9H,5H2,1-2H3,(H2,16,17,18)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to human 5HT5A receptor				Bioorg Med Chem Lett 18: 262-6 (2008) Article DOI: 10.1016/j.bmcl.2007.10.078 BindingDB Entry DOI: 10.7270/Q2FJ2HNN
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50371983 (CHEMBL257744) Show SMILES COc1c(Cl)ccc2N=C(NCC(F)F)NC(C)c12 |t:8| Show InChI InChI=1S/C12H14ClF2N3O/c1-6-10-8(4-3-7(13)11(10)19-2)18-12(17-6)16-5-9(14)15/h3-4,6,9H,5H2,1-2H3,(H2,16,17,18)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	233	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to 5HT2C receptor				Bioorg Med Chem Lett 18: 262-6 (2008) Article DOI: 10.1016/j.bmcl.2007.10.078 BindingDB Entry DOI: 10.7270/Q2FJ2HNN
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50371983 (CHEMBL257744) Show SMILES COc1c(Cl)ccc2N=C(NCC(F)F)NC(C)c12 |t:8| Show InChI InChI=1S/C12H14ClF2N3O/c1-6-10-8(4-3-7(13)11(10)19-2)18-12(17-6)16-5-9(14)15/h3-4,6,9H,5H2,1-2H3,(H2,16,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	348	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to 5HT1A receptor				Bioorg Med Chem Lett 18: 262-6 (2008) Article DOI: 10.1016/j.bmcl.2007.10.078 BindingDB Entry DOI: 10.7270/Q2FJ2HNN
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50371983 (CHEMBL257744) Show SMILES COc1c(Cl)ccc2N=C(NCC(F)F)NC(C)c12 |t:8| Show InChI InChI=1S/C12H14ClF2N3O/c1-6-10-8(4-3-7(13)11(10)19-2)18-12(17-6)16-5-9(14)15/h3-4,6,9H,5H2,1-2H3,(H2,16,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.81E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to 5HT1D receptor				Bioorg Med Chem Lett 18: 262-6 (2008) Article DOI: 10.1016/j.bmcl.2007.10.078 BindingDB Entry DOI: 10.7270/Q2FJ2HNN
					More data for this Ligand-Target Pair