Compile Data Set for Download or QSAR

Found 250 hits Enz. Inhib. hit(s) with all data for entry = 50044798   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM295691 (Example 38 in WO2010036630 | US10570125, Example 3...) Show SMILES COCC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)C2CCOCC2)on1 Show InChI InChI=1S/C17H28N2O6S/c1-16(2,11-23-5)13-10-14(25-19-13)18-15(20)17(3,4)26(21,22)12-6-8-24-9-7-12/h10,12H,6-9,11H2,1-5H3,(H,18,20)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM295702 (US10112934, Example 8 | US10570125, Example 8 | US...) Show SMILES CN(C1CCN(CC1)S(C)(=O)=O)C(C)(C)C(=O)Nc1nnc(s1)C(C)(C)C#N Show InChI InChI=1S/C17H28N6O3S2/c1-16(2,11-18)14-20-21-15(27-14)19-13(24)17(3,4)22(5)12-7-9-23(10-8-12)28(6,25)26/h12H,7-10H2,1-6H3,(H,19,21,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	6.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM295698 (US10112934, Example 6 | US10570125, Example 6 | US...) Show SMILES CC(C)(C#N)c1cc(NC(=O)[C@@H]2CCCN2C2CCOCC2)on1 |r| Show InChI InChI=1S/C17H24N4O3/c1-17(2,11-18)14-10-15(24-20-14)19-16(22)13-4-3-7-21(13)12-5-8-23-9-6-12/h10,12-13H,3-9H2,1-2H3,(H,19,22)/t13-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	8.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM435491 (US10570125, Example 1 | US11084810, Example 1 | US...) Show SMILES CC(C)(C#N)c1cc(NC(=O)C(C)(C)S(=O)(=O)CCCC(F)(F)F)on1 Show InChI InChI=1S/C15H20F3N3O4S/c1-13(2,9-19)10-8-11(25-21-10)20-12(22)14(3,4)26(23,24)7-5-6-15(16,17)18/h8H,5-7H2,1-4H3,(H,20,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.04E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM295701 (Example 30 in WO2010147792 | US10570125, Example 3...) Show SMILES CN(CC1CCOCC1)C(C)(C)C(=O)Nc1nnc(s1)C(C)(C)CO Show InChI InChI=1S/C17H30N4O3S/c1-16(2,11-22)14-19-20-15(25-14)18-13(23)17(3,4)21(5)10-12-6-8-24-9-7-12/h12,22H,6-11H2,1-5H3,(H,18,20,23)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50006447 (CHEMBL3234702 | Example 2 in WO2010036630 | US1108...) Show SMILES CC(C)(CO)c1cc(NC(=O)C(C)(C)S(=O)(=O)C2CCOCC2)on1 Show InChI InChI=1S/C16H26N2O6S/c1-15(2,10-19)12-9-13(24-18-12)17-14(20)16(3,4)25(21,22)11-5-7-23-8-6-11/h9,11,19H,5-8,10H2,1-4H3,(H,17,20)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem		n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM295689 (US10112934, Example 3 | US10570125, Example 3 | US...) Show SMILES CC(C)(C#N)c1cc(NC(=O)C(C)(C)S(=O)(=O)C2CCOCC2)on1 Show InChI InChI=1S/C16H23N3O5S/c1-15(2,10-17)12-9-13(24-19-12)18-14(20)16(3,4)25(21,22)11-5-7-23-8-6-11/h9,11H,5-8H2,1-4H3,(H,18,20)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM295673 (US10112934, Example 2 | US10570125, Example 2 | US...) Show SMILES CC(C)(C#N)c1cc(NC(=O)C(C)(C)S(=O)(=O)CC2CCOCC2)on1 Show InChI InChI=1S/C17H25N3O5S/c1-16(2,11-18)13-9-14(25-20-13)19-15(21)17(3,4)26(22,23)10-12-5-7-24-8-6-12/h9,12H,5-8,10H2,1-4H3,(H,19,21)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM295700 (US10112934, Example 7 | US11084810, Example 7 | US...) Show SMILES CN(CC1CCOCC1)C(C)(C)C(=O)Nc1nnc(s1)C(C)(C)C#N Show InChI InChI=1S/C17H27N5O2S/c1-16(2,11-18)14-20-21-15(25-14)19-13(23)17(3,4)22(5)10-12-6-8-24-9-7-12/h12H,6-10H2,1-5H3,(H,19,21,23)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM295692 (Example 133 in WO2010036630 | US10570125, Example ...) Show SMILES CC(C)(O)c1cc(NC(=O)C(C)(C)S(=O)(=O)C2CCOCC2)on1 Show InChI InChI=1S/C15H24N2O6S/c1-14(2,19)11-9-12(23-17-11)16-13(18)15(3,4)24(20,21)10-5-7-22-8-6-10/h9-10,19H,5-8H2,1-4H3,(H,16,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1X7B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334401 (10-[3-(2-Fluoro-phenoxy)-azetidin-1-yl]-6,7,8,9-te...) Show SMILES Fc1ccccc1OC1CN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C19H20FN5O/c20-15-3-1-2-4-17(15)26-13-11-24(12-13)19-14-5-8-21-9-6-16(14)23-18-7-10-22-25(18)19/h1-4,7,10,13,21H,5-6,8-9,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334402 (10-Azetidin-1-yl-6,7,8,9-tetrahydro-5H-1,4,7,10a-t...) Show SMILES C1CN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C13H17N5/c1-8-17(9-1)13-10-2-5-14-6-3-11(10)16-12-4-7-15-18(12)13/h4,7,14H,1-3,5-6,8-9H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.40	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334403 (5-[1-(6,7,8,9-Tetrahydro-5H-1,4,7,10a-tetraaza-cyc...) Show SMILES O=C1Cc2cc(OC3CN(C3)c3c4CCNCCc4nc4ccnn34)ccc2N1 Show InChI InChI=1S/C21H22N6O2/c28-20-10-13-9-14(1-2-17(13)25-20)29-15-11-26(12-15)21-16-3-6-22-7-4-18(16)24-19-5-8-23-27(19)21/h1-2,5,8-9,15,22H,3-4,6-7,10-12H2,(H,25,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	8.40	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334404 (10-(3-Phenoxy-azetidin-1-yl)-6,7,8,9-tetrahydro-5H...) Show SMILES C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccccc1 Show InChI InChI=1S/C19H21N5O/c1-2-4-14(5-3-1)25-15-12-23(13-15)19-16-6-9-20-10-7-17(16)22-18-8-11-21-24(18)19/h1-5,8,11,15,20H,6-7,9-10,12-13H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	18	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334405 (10-[3-(4-Fluoro-phenoxy)-azetidin-1-yl]-6,7,8,9-te...) Show SMILES Fc1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1 Show InChI InChI=1S/C19H20FN5O/c20-13-1-3-14(4-2-13)26-15-11-24(12-15)19-16-5-8-21-9-6-17(16)23-18-7-10-22-25(18)19/h1-4,7,10,15,21H,5-6,8-9,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	23	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334406 (10-[3-(3-Fluoro-phenoxy)-azetidin-1-yl]-6,7,8,9-te...) Show SMILES Fc1cccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)c1 Show InChI InChI=1S/C19H20FN5O/c20-13-2-1-3-14(10-13)26-15-11-24(12-15)19-16-4-7-21-8-5-17(16)23-18-6-9-22-25(18)19/h1-3,6,9-10,15,21H,4-5,7-8,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	25	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334407 (10-[3-(Pyridin-2-yloxy)-azetidin-1-yl]-6,7,8,9-tet...) Show SMILES C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccccn1 Show InChI InChI=1S/C18H20N6O/c1-2-7-20-17(3-1)25-13-11-23(12-13)18-14-4-8-19-9-5-15(14)22-16-6-10-21-24(16)18/h1-3,6-7,10,13,19H,4-5,8-9,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	37	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334408 (CHEMBL1643674 | Ethyl-(6,7,8,9-tetrahydro-5H-1,4,7...) Show SMILES CCNc1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C12H17N5/c1-2-14-12-9-3-6-13-7-4-10(9)16-11-5-8-15-17(11)12/h5,8,13-14H,2-4,6-7H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	63	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334409 (10-[3-(3-Methoxy-phenoxy)-azetidin-1-yl]-6,7,8,9-t...) Show SMILES COc1cccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)c1 Show InChI InChI=1S/C20H23N5O2/c1-26-14-3-2-4-15(11-14)27-16-12-24(13-16)20-17-5-8-21-9-6-18(17)23-19-7-10-22-25(19)20/h2-4,7,10-11,16,21H,5-6,8-9,12-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	65	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334410 (10-[3-(2-Methoxy-phenoxy)-azetidin-1-yl]-6,7,8,9-t...) Show SMILES COc1ccccc1OC1CN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C20H23N5O2/c1-26-17-4-2-3-5-18(17)27-14-12-24(13-14)20-15-6-9-21-10-7-16(15)23-19-8-11-22-25(19)20/h2-5,8,11,14,21H,6-7,9-10,12-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	84	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334411 (10-[3-(4-Methoxy-phenoxy)-azetidin-1-yl]-6,7,8,9-t...) Show SMILES COc1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1 Show InChI InChI=1S/C20H23N5O2/c1-26-14-2-4-15(5-3-14)27-16-12-24(13-16)20-17-6-9-21-10-7-18(17)23-19-8-11-22-25(19)20/h2-5,8,11,16,21H,6-7,9-10,12-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	95	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334412 (CHEMBL1643858 | N-Methyl-N-{4-[1-(6,7,8,9-tetrahyd...) Show SMILES CN(C(C)=O)c1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1 Show InChI InChI=1S/C22H26N6O2/c1-15(29)26(2)16-3-5-17(6-4-16)30-18-13-27(14-18)22-19-7-10-23-11-8-20(19)25-21-9-12-24-28(21)22/h3-6,9,12,18,23H,7-8,10-11,13-14H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	188	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334413 (10-[3-(Pyridin-3-yloxy)-azetidin-1-yl]-6,7,8,9-tet...) Show SMILES C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1cccnc1 Show InChI InChI=1S/C18H20N6O/c1-2-13(10-20-6-1)25-14-11-23(12-14)18-15-3-7-19-8-4-16(15)22-17-5-9-21-24(17)18/h1-2,5-6,9-10,14,19H,3-4,7-8,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	211	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334414 (CHEMBL1643673 | Ethyl-methyl-(6,7,8,9-tetrahydro-5...) Show SMILES CCN(C)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C13H19N5/c1-3-17(2)13-10-4-7-14-8-5-11(10)16-12-6-9-15-18(12)13/h6,9,14H,3-5,7-8H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	362	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334415 (10-[3-(Pyridin-4-yloxy)-azetidin-1-yl]-6,7,8,9-tet...) Show SMILES C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccncc1 Show InChI InChI=1S/C18H20N6O/c1-6-19-7-2-13(1)25-14-11-23(12-14)18-15-3-8-20-9-4-16(15)22-17-5-10-21-24(17)18/h1-2,5-7,10,14,20H,3-4,8-9,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	574	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334416 (10-Pyrrolidin-1-yl-6,7,8,9-tetrahydro-5H-1,4,7,10a...) Show SMILES C1CCN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C14H19N5/c1-2-10-18(9-1)14-11-3-6-15-7-4-12(11)17-13-5-8-16-19(13)14/h5,8,15H,1-4,6-7,9-10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	764	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50334417 (10-Piperidin-1-yl-6,7,8,9-tetrahydro-5H-1,4,7,10a-...) Show SMILES C1CCN(CC1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C15H21N5/c1-2-10-19(11-3-1)15-12-4-7-16-8-5-13(12)18-14-6-9-17-20(14)15/h6,9,16H,1-5,7-8,10-11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	4.56E+3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2C receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334405 (10-[3-(4-Fluoro-phenoxy)-azetidin-1-yl]-6,7,8,9-te...) Show SMILES Fc1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1 Show InChI InChI=1S/C19H20FN5O/c20-13-1-3-14(4-2-13)26-15-11-24(12-15)19-16-5-8-21-9-6-17(16)23-18-7-10-22-25(18)19/h1-4,7,10,15,21H,5-6,8-9,11-12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334406 (10-[3-(3-Fluoro-phenoxy)-azetidin-1-yl]-6,7,8,9-te...) Show SMILES Fc1cccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)c1 Show InChI InChI=1S/C19H20FN5O/c20-13-2-1-3-14(10-13)26-15-11-24(12-15)19-16-4-7-21-8-5-17(16)23-18-6-9-22-25(18)19/h1-3,6,9-10,15,21H,4-5,7-8,11-12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	32	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334409 (10-[3-(3-Methoxy-phenoxy)-azetidin-1-yl]-6,7,8,9-t...) Show SMILES COc1cccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)c1 Show InChI InChI=1S/C20H23N5O2/c1-26-14-3-2-4-15(11-14)27-16-12-24(13-16)20-17-5-8-21-9-6-18(17)23-19-7-10-22-25(19)20/h2-4,7,10-11,16,21H,5-6,8-9,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334413 (10-[3-(Pyridin-3-yloxy)-azetidin-1-yl]-6,7,8,9-tet...) Show SMILES C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1cccnc1 Show InChI InChI=1S/C18H20N6O/c1-2-13(10-20-6-1)25-14-11-23(12-14)18-15-3-7-19-8-4-16(15)22-17-5-9-21-24(17)18/h1-2,5-6,9-10,14,19H,3-4,7-8,11-12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	63	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334408 (CHEMBL1643674 | Ethyl-(6,7,8,9-tetrahydro-5H-1,4,7...) Show SMILES CCNc1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C12H17N5/c1-2-14-12-9-3-6-13-7-4-10(9)16-11-5-8-15-17(11)12/h5,8,13-14H,2-4,6-7H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	138	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334417 (10-Piperidin-1-yl-6,7,8,9-tetrahydro-5H-1,4,7,10a-...) Show SMILES C1CCN(CC1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C15H21N5/c1-2-10-19(11-3-1)15-12-4-7-16-8-5-13(12)18-14-6-9-17-20(14)15/h6,9,16H,1-5,7-8,10-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	585	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334401 (10-[3-(2-Fluoro-phenoxy)-azetidin-1-yl]-6,7,8,9-te...) Show SMILES Fc1ccccc1OC1CN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C19H20FN5O/c20-15-3-1-2-4-17(15)26-13-11-24(12-13)19-14-5-8-21-9-6-16(14)23-18-7-10-22-25(18)19/h1-4,7,10,13,21H,5-6,8-9,11-12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	648	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334403 (5-[1-(6,7,8,9-Tetrahydro-5H-1,4,7,10a-tetraaza-cyc...) Show SMILES O=C1Cc2cc(OC3CN(C3)c3c4CCNCCc4nc4ccnn34)ccc2N1 Show InChI InChI=1S/C21H22N6O2/c28-20-10-13-9-14(1-2-17(13)25-20)29-15-11-26(12-15)21-16-3-6-22-7-4-18(16)24-19-5-8-23-27(19)21/h1-2,5,8-9,15,22H,3-4,6-7,10-12H2,(H,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	762	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334415 (10-[3-(Pyridin-4-yloxy)-azetidin-1-yl]-6,7,8,9-tet...) Show SMILES C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccncc1 Show InChI InChI=1S/C18H20N6O/c1-6-19-7-2-13(1)25-14-11-23(12-14)18-15-3-8-20-9-4-16(15)22-17-5-10-21-24(17)18/h1-2,5-7,10,14,20H,3-4,8-9,11-12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.23E+3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334412 (CHEMBL1643858 | N-Methyl-N-{4-[1-(6,7,8,9-tetrahyd...) Show SMILES CN(C(C)=O)c1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1 Show InChI InChI=1S/C22H26N6O2/c1-15(29)26(2)16-3-5-17(6-4-16)30-18-13-27(14-18)22-19-7-10-23-11-8-20(19)25-21-9-12-24-28(21)22/h3-6,9,12,18,23H,7-8,10-11,13-14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.05E+3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334416 (10-Pyrrolidin-1-yl-6,7,8,9-tetrahydro-5H-1,4,7,10a...) Show SMILES C1CCN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C14H19N5/c1-2-10-18(9-1)14-11-3-6-15-7-4-12(11)17-13-5-8-16-19(13)14/h5,8,15H,1-4,6-7,9-10H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.31E+3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334402 (10-Azetidin-1-yl-6,7,8,9-tetrahydro-5H-1,4,7,10a-t...) Show SMILES C1CN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C13H17N5/c1-8-17(9-1)13-10-2-5-14-6-3-11(10)16-12-4-7-15-18(12)13/h4,7,14H,1-3,5-6,8-9H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.35E+3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334411 (10-[3-(4-Methoxy-phenoxy)-azetidin-1-yl]-6,7,8,9-t...) Show SMILES COc1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1 Show InChI InChI=1S/C20H23N5O2/c1-26-14-2-4-15(5-3-14)27-16-12-24(13-16)20-17-6-9-21-10-7-18(17)23-19-8-11-22-25(19)20/h2-5,8,11,16,21H,6-7,9-10,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.63E+3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334410 (10-[3-(2-Methoxy-phenoxy)-azetidin-1-yl]-6,7,8,9-t...) Show SMILES COc1ccccc1OC1CN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C20H23N5O2/c1-26-17-4-2-3-5-18(17)27-14-12-24(13-14)20-15-6-9-21-10-7-16(15)23-19-8-11-22-25(19)20/h2-5,8,11,14,21H,6-7,9-10,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.68E+3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334407 (10-[3-(Pyridin-2-yloxy)-azetidin-1-yl]-6,7,8,9-tet...) Show SMILES C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccccn1 Show InChI InChI=1S/C18H20N6O/c1-2-7-20-17(3-1)25-13-11-23(12-13)18-14-4-8-19-9-5-15(14)22-16-6-10-21-24(16)18/h1-3,6-7,10,13,19H,4-5,8-9,11-12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.17E+3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50334404 (10-(3-Phenoxy-azetidin-1-yl)-6,7,8,9-tetrahydro-5H...) Show SMILES C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccccc1 Show InChI InChI=1S/C19H21N5O/c1-2-4-14(5-3-1)25-15-12-23(13-15)19-16-6-9-20-10-7-17(16)22-18-8-11-21-24(18)19/h1-5,8,11,15,20H,6-7,9-10,12-13H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	7.77E+3	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2A receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50334406 (10-[3-(3-Fluoro-phenoxy)-azetidin-1-yl]-6,7,8,9-te...) Show SMILES Fc1cccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)c1 Show InChI InChI=1S/C19H20FN5O/c20-13-2-1-3-14(10-13)26-15-11-24(12-15)19-16-4-7-21-8-5-17(16)23-18-6-9-22-25(18)19/h1-3,6,9-10,15,21H,4-5,7-8,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	13	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2B receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50334403 (5-[1-(6,7,8,9-Tetrahydro-5H-1,4,7,10a-tetraaza-cyc...) Show SMILES O=C1Cc2cc(OC3CN(C3)c3c4CCNCCc4nc4ccnn34)ccc2N1 Show InChI InChI=1S/C21H22N6O2/c28-20-10-13-9-14(1-2-17(13)25-20)29-15-11-26(12-15)21-16-3-6-22-7-4-18(16)24-19-5-8-23-27(19)21/h1-2,5,8-9,15,22H,3-4,6-7,10-12H2,(H,25,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	73	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2B receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50334402 (10-Azetidin-1-yl-6,7,8,9-tetrahydro-5H-1,4,7,10a-t...) Show SMILES C1CN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C13H17N5/c1-8-17(9-1)13-10-2-5-14-6-3-11(10)16-12-4-7-15-18(12)13/h4,7,14H,1-3,5-6,8-9H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	94	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2B receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50334401 (10-[3-(2-Fluoro-phenoxy)-azetidin-1-yl]-6,7,8,9-te...) Show SMILES Fc1ccccc1OC1CN(C1)c1c2CCNCCc2nc2ccnn12 Show InChI InChI=1S/C19H20FN5O/c20-15-3-1-2-4-17(15)26-13-11-24(12-13)19-14-5-8-21-9-6-16(14)23-18-7-10-22-25(18)19/h1-4,7,10,13,21H,5-6,8-9,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	94	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2B receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50334405 (10-[3-(4-Fluoro-phenoxy)-azetidin-1-yl]-6,7,8,9-te...) Show SMILES Fc1ccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)cc1 Show InChI InChI=1S/C19H20FN5O/c20-13-1-3-14(4-2-13)26-15-11-24(12-15)19-16-5-8-21-9-6-17(16)23-18-7-10-22-25(18)19/h1-4,7,10,15,21H,5-6,8-9,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	163	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2B receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50334409 (10-[3-(3-Methoxy-phenoxy)-azetidin-1-yl]-6,7,8,9-t...) Show SMILES COc1cccc(OC2CN(C2)c2c3CCNCCc3nc3ccnn23)c1 Show InChI InChI=1S/C20H23N5O2/c1-26-14-3-2-4-15(11-14)27-16-12-24(13-16)20-17-5-8-21-9-6-18(17)23-19-7-10-22-25(19)20/h2-4,7,10-11,16,21H,5-6,8-9,12-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	215	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2B receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50334404 (10-(3-Phenoxy-azetidin-1-yl)-6,7,8,9-tetrahydro-5H...) Show SMILES C1C(CN1c1c2CCNCCc2nc2ccnn12)Oc1ccccc1 Show InChI InChI=1S/C19H21N5O/c1-2-4-14(5-3-1)25-15-12-23(13-15)19-16-6-9-20-10-7-17(16)22-18-8-11-21-24(18)19/h1-5,8,11,15,20H,6-7,9-10,12-13H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	218	n/a	n/a	n/a	n/a
Evotec UK Ltd Curated by ChEMBL					Assay Description Agonist activity at human recombinant 5HT2B receptor expressed in CHOK1 cells assessed as induction of intracellular calcium release by FLIPR assay				Bioorg Med Chem Lett 21: 34-7 (2010) Article DOI: 10.1016/j.bmcl.2010.11.089 BindingDB Entry DOI: 10.7270/Q2CR5TMH
					More data for this Ligand-Target Pair

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