null

SMILES: Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl

InChI Key: InChIKey=NCKUXAJTZOKPEP-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50457576   

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))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from recombinant human 5-HT1A receptor expressed in HEK293 cell membranes after 60 mins by liquid scintillation countin...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	76	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from recombinant human 5-HT2A receptor expressed in HEK293 cell membranes after 60 mins by liquid scintillation counti...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]LSD from recombinant human 5-HT7 receptor expressed in CHO cells cell membranes after 60 mins by liquid scintillation counting me...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	93	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]prazosin from recombinant human alpha1 adrenoceptor expressed in CHO cell membranes after 30 mins by liquid scintillation countin...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	299	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]methylspiperonee from recombinant human D2 receptor expressed in HEK293 cells cell membranes after 60 mins by liquid scintillatio...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 6 (Homo sapiens (Human))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]LSD from recombinant human 5-HT6 receptor expressed in CHO cells cell membranes after 60 mins by liquid scintillation counting me...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	757	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Agonist activity at human D2 receptor expressed in CHO-K1 cells co-expressing Galphaqi5 assessed as increase in calcium mobilization measured for 30 ...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.79E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Antagonist activity at human 5-HT7 receptor expressed in CHO-K1 cells assessed as decrease in serotonin-induced cAMP level after 1 hr by TR-FRET assa...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Antagonist activity at human 5-HT2A receptor expressed in CHO-K1 cells co-expressing Galpha16 assessed as decrease in serotonin calcium mobilization ...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50457576 (CHEMBL4212812) Show SMILES Cl.Cl.Cc1cc(OCCCN2CCN(CC2)c2ccccc2)ccc1Cl Show InChI InChI=1S/C20H25ClN2O/c1-17-16-19(8-9-20(17)21)24-15-5-10-22-11-13-23(14-12-22)18-6-3-2-4-7-18/h2-4,6-9,16H,5,10-15H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	291	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Antagonist activity at human 5-HT1A receptor expressed in CHO-K1 cells co-expressing Galpha16 assessed as decrease in serotonin calcium mobilization ...				Bioorg Med Chem Lett 28: 2039-2049 (2018) Article DOI: 10.1016/j.bmcl.2018.04.059 BindingDB Entry DOI: 10.7270/Q2CJ8H4K
					More data for this Ligand-Target Pair