Compile Data Set for Download or QSAR

Found 26 hits Enz. Inhib. hit(s) with all data for entry = 50001485   

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
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281369 (CHEMBL4162750) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2cccc(C)c12 |r| Show InChI InChI=1S/C16H24N4O/c1-3-4-7-12(9-10-21)18-15-14-11(2)6-5-8-13(14)19-16(17)20-15/h5-6,8,12,21H,3-4,7,9-10H2,1-2H3,(H3,17,18,19,20)/t12-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50281371 (CHEMBL4171368) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cc(OC)ccc12 |r| Show InChI InChI=1S/C15H22N4O2/c1-3-4-10(7-8-20)17-14-12-6-5-11(21-2)9-13(12)18-15(16)19-14/h5-6,9-10,20H,3-4,7-8H2,1-2H3,(H3,16,17,18,19)/t10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of CYP2D6 (unknown origin)				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50281371 (CHEMBL4171368) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cc(OC)ccc12 |r| Show InChI InChI=1S/C15H22N4O2/c1-3-4-10(7-8-20)17-14-12-6-5-11(21-2)9-13(12)18-15(16)19-14/h5-6,9-10,20H,3-4,7-8H2,1-2H3,(H3,16,17,18,19)/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.78E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of 5-HT2A receptor (unknown origin)				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281374 (CHEMBL4160103) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2cc(C)ccc12 |r| Show InChI InChI=1S/C16H24N4O/c1-3-4-5-12(8-9-21)18-15-13-7-6-11(2)10-14(13)19-16(17)20-15/h6-7,10,12,21H,3-5,8-9H2,1-2H3,(H3,17,18,19,20)/t12-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50281371 (CHEMBL4171368) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cc(OC)ccc12 |r| Show InChI InChI=1S/C15H22N4O2/c1-3-4-10(7-8-20)17-14-12-6-5-11(21-2)9-13(12)18-15(16)19-14/h5-6,9-10,20H,3-4,7-8H2,1-2H3,(H3,16,17,18,19)/t10-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of adenosine A1 receptor (unknown origin)				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281377 (CHEMBL4170169) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2ccccc12 |r| Show InChI InChI=1S/C15H22N4O/c1-2-3-6-11(9-10-20)17-14-12-7-4-5-8-13(12)18-15(16)19-14/h4-5,7-8,11,20H,2-3,6,9-10H2,1H3,(H3,16,17,18,19)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281375 (CHEMBL4166919) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2cc(OC)ccc12 |r| Show InChI InChI=1S/C16H24N4O2/c1-3-4-5-11(8-9-21)18-15-13-7-6-12(22-2)10-14(13)19-16(17)20-15/h6-7,10-11,21H,3-5,8-9H2,1-2H3,(H3,17,18,19,20)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281384 (CHEMBL4170320) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2c(F)cccc12 |r| Show InChI InChI=1S/C15H21FN4O/c1-2-3-5-10(8-9-21)18-14-11-6-4-7-12(16)13(11)19-15(17)20-14/h4,6-7,10,21H,2-3,5,8-9H2,1H3,(H3,17,18,19,20)/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281383 (CHEMBL4163469) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2cc(F)ccc12 |r| Show InChI InChI=1S/C15H21FN4O/c1-2-3-4-11(7-8-21)18-14-12-6-5-10(16)9-13(12)19-15(17)20-14/h5-6,9,11,21H,2-4,7-8H2,1H3,(H3,17,18,19,20)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281380 (CHEMBL4174506) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2ccc(C)cc12 |r| Show InChI InChI=1S/C16H24N4O/c1-3-4-5-12(8-9-21)18-15-13-10-11(2)6-7-14(13)19-16(17)20-15/h6-7,10,12,21H,3-5,8-9H2,1-2H3,(H3,17,18,19,20)/t12-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281378 (CHEMBL4175502) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cccc(C)c12 |r| Show InChI InChI=1S/C15H22N4O/c1-3-5-11(8-9-20)17-14-13-10(2)6-4-7-12(13)18-15(16)19-14/h4,6-7,11,20H,3,5,8-9H2,1-2H3,(H3,16,17,18,19)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50281376 (CHEMBL4174813) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2c(F)cccc12 |r| Show InChI InChI=1S/C14H19FN4O/c1-2-4-9(7-8-20)17-13-10-5-3-6-11(15)12(10)18-14(16)19-13/h3,5-6,9,20H,2,4,7-8H2,1H3,(H3,16,17,18,19)/t9-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of CYP2D6 (unknown origin)				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50281371 (CHEMBL4171368) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cc(OC)ccc12 |r| Show InChI InChI=1S/C15H22N4O2/c1-3-4-10(7-8-20)17-14-12-6-5-11(21-2)9-13(12)18-15(16)19-14/h5-6,9-10,20H,3-4,7-8H2,1-2H3,(H3,16,17,18,19)/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of dopamine D1 receptor (unknown origin)				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281381 (CHEMBL4159383) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2ccc(F)cc12 |r| Show InChI InChI=1S/C15H21FN4O/c1-2-3-4-11(7-8-21)18-14-12-9-10(16)5-6-13(12)19-15(17)20-14/h5-6,9,11,21H,2-4,7-8H2,1H3,(H3,17,18,19,20)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281386 (CHEMBL4176397) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2ccc(OC)cc12 |r| Show InChI InChI=1S/C16H24N4O2/c1-3-4-5-11(8-9-21)18-15-13-10-12(22-2)6-7-14(13)19-16(17)20-15/h6-7,10-11,21H,3-5,8-9H2,1-2H3,(H3,17,18,19,20)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281372 (CHEMBL4162255) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2ccccc12 |r| Show InChI InChI=1S/C14H20N4O/c1-2-5-10(8-9-19)16-13-11-6-3-4-7-12(11)17-14(15)18-13/h3-4,6-7,10,19H,2,5,8-9H2,1H3,(H3,15,16,17,18)/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281373 (CHEMBL4176810) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2ccc(C)cc12 |r| Show InChI InChI=1S/C15H22N4O/c1-3-4-11(7-8-20)17-14-12-9-10(2)5-6-13(12)18-15(16)19-14/h5-6,9,11,20H,3-4,7-8H2,1-2H3,(H3,16,17,18,19)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281382 (CHEMBL4168533) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cc(C)ccc12 |r| Show InChI InChI=1S/C15H22N4O/c1-3-4-11(7-8-20)17-14-12-6-5-10(2)9-13(12)18-15(16)19-14/h5-6,9,11,20H,3-4,7-8H2,1-2H3,(H3,16,17,18,19)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281385 (CHEMBL4173454) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cccc(F)c12 |r| Show InChI InChI=1S/C14H19FN4O/c1-2-4-9(7-8-20)17-13-12-10(15)5-3-6-11(12)18-14(16)19-13/h3,5-6,9,20H,2,4,7-8H2,1H3,(H3,16,17,18,19)/t9-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281370 (CHEMBL4168028) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cc(F)ccc12 |r| Show InChI InChI=1S/C14H19FN4O/c1-2-3-10(6-7-20)17-13-11-5-4-9(15)8-12(11)18-14(16)19-13/h4-5,8,10,20H,2-3,6-7H2,1H3,(H3,16,17,18,19)/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281387 (CHEMBL4166593) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2ccc(F)cc12 |r| Show InChI InChI=1S/C14H19FN4O/c1-2-3-10(6-7-20)17-13-11-8-9(15)4-5-12(11)18-14(16)19-13/h4-5,8,10,20H,2-3,6-7H2,1H3,(H3,16,17,18,19)/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281379 (CHEMBL4166194) Show SMILES CCCC[C@@H](CCO)Nc1nc(N)nc2cccc(F)c12 |r| Show InChI InChI=1S/C15H21FN4O/c1-2-3-5-10(8-9-21)18-14-13-11(16)6-4-7-12(13)19-15(17)20-14/h4,6-7,10,21H,2-3,5,8-9H2,1H3,(H3,17,18,19,20)/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50281376 (CHEMBL4174813) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2c(F)cccc12 |r| Show InChI InChI=1S/C14H19FN4O/c1-2-4-9(7-8-20)17-13-10-5-3-6-11(15)12(10)18-14(16)19-13/h3,5-6,9,20H,2,4,7-8H2,1H3,(H3,16,17,18,19)/t9-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of dopamine D1 receptor (unknown origin)				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50281376 (CHEMBL4174813) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2c(F)cccc12 |r| Show InChI InChI=1S/C14H19FN4O/c1-2-4-9(7-8-20)17-13-10-5-3-6-11(15)12(10)18-14(16)19-13/h3,5-6,9,20H,2,4,7-8H2,1H3,(H3,16,17,18,19)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of adenosine A1 receptor (unknown origin)				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281376 (CHEMBL4174813) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2c(F)cccc12 |r| Show InChI InChI=1S/C14H19FN4O/c1-2-4-9(7-8-20)17-13-10-5-3-6-11(15)12(10)18-14(16)19-13/h3,5-6,9,20H,2,4,7-8H2,1H3,(H3,16,17,18,19)/t9-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50281371 (CHEMBL4171368) Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cc(OC)ccc12 |r| Show InChI InChI=1S/C15H22N4O2/c1-3-4-10(7-8-20)17-14-12-6-5-11(21-2)9-13(12)18-15(16)19-14/h5-6,9-10,20H,3-4,7-8H2,1-2H3,(H3,16,17,18,19)/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Infectious Diseases-Diagnostics BVBA Curated by ChEMBL					Assay Description Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method				J Med Chem 61: 6236-6246 (2018) Article DOI: 10.1021/acs.jmedchem.8b00643 BindingDB Entry DOI: 10.7270/Q2057JFF
					More data for this Ligand-Target Pair