null

SMILES: Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1

InChI Key: InChIKey=JJACJGJMQKKPIZ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50457577   

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
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	14	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
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	32	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 7 (Homo sapiens (Human))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	89	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
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	159	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
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	162	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))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.54E+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))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	79	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 D2 receptor expressed in CHO-K1 cells co-expressing Galphaqi5 assessed as decrease in apomorphine-induced calcium mobili...				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))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.01E+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-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))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	376	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
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50457577 (CHEMBL4213352) Show SMILES Cl.Cl.COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1 Show InChI InChI=1S/C24H34N2O3/c1-19-17-20(2)21(3)24(18-19)29-16-15-28-14-13-25-9-11-26(12-10-25)22-7-5-6-8-23(22)27-4/h5-8,17-18H,9-16H2,1-4H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.34E+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