Compile Data Set for Download or QSAR

Found 34 hits Enz. Inhib. hit(s) with all data for entry = 50035947   

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
Adenosine receptor A1 (GUINEA PIG)	BDBM50368242 (CHEMBL603589) Show SMILES Nc1nc(OCCC2CCCC2)nc2n(cnc12)C1O[C@@H](CO)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C17H25N5O5/c18-14-11-15(21-17(20-14)26-6-5-9-3-1-2-4-9)22(8-19-11)16-13(25)12(24)10(7-23)27-16/h8-10,12-13,16,23-25H,1-7H2,(H2,18,20,21)/t10-,12-,13-,16?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.41E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50421888 (CHEMBL2311198) Show SMILES COc1nc(N)c2ncn([C@H]3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C11H15N5O5/c1-20-11-14-8(12)5-9(15-11)16(3-13-5)10-7(19)6(18)4(2-17)21-10/h3-4,6-7,10,17-19H,2H2,1H3,(H2,12,14,15)/t4-,6-,7-,10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	9.33E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368245 (CHEMBL604009) Show SMILES CCC(CC)COc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C16H25N5O5/c1-3-8(4-2)6-25-16-19-13(17)10-14(20-16)21(7-18-10)15-12(24)11(23)9(5-22)26-15/h7-9,11-12,15,22-24H,3-6H2,1-2H3,(H2,17,19,20)/t9-,11-,12-,15?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	3.55E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368246 (CHEMBL604224) Show SMILES CC(C)CCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C15H23N5O5/c1-7(2)3-4-24-15-18-12(16)9-13(19-15)20(6-17-9)14-11(23)10(22)8(5-21)25-14/h6-8,10-11,14,21-23H,3-5H2,1-2H3,(H2,16,18,19)/t8-,10-,11-,14?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	6.61E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368247 (CHEMBL604838) Show SMILES CC(C)COc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C14H21N5O5/c1-6(2)4-23-14-17-11(15)8-12(18-14)19(5-16-8)13-10(22)9(21)7(3-20)24-13/h5-7,9-10,13,20-22H,3-4H2,1-2H3,(H2,15,17,18)/t7-,9-,10-,13?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.07E+5	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368248 (CHEMBL605472) Show SMILES Nc1nc(OC2CCCCC2)nc2n(cnc12)C1O[C@@H](CO)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C16H23N5O5/c17-13-10-14(20-16(19-13)25-8-4-2-1-3-5-8)21(7-18-10)15-12(24)11(23)9(6-22)26-15/h7-9,11-12,15,22-24H,1-6H2,(H2,17,19,20)/t9-,11-,12-,15?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368254 (CHEMBL605464) Show SMILES CCCCCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C15H23N5O5/c1-2-3-4-5-24-15-18-12(16)9-13(19-15)20(7-17-9)14-11(23)10(22)8(6-21)25-14/h7-8,10-11,14,21-23H,2-6H2,1H3,(H2,16,18,19)/t8-,10-,11-,14?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	4.57E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368256 (CHEMBL603374) Show SMILES CC#CCCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C15H19N5O5/c1-2-3-4-5-24-15-18-12(16)9-13(19-15)20(7-17-9)14-11(23)10(22)8(6-21)25-14/h7-8,10-11,14,21-23H,4-6H2,1H3,(H2,16,18,19)/t8-,10-,11-,14?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	6.31E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50009525 (2-CI Adenosine | 2-Chloroadenosine | 2-Chloroado |...) Show SMILES Nc1nc(Cl)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H12ClN5O4/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,14,15)/t3-,5-,6-,9-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	191	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368255 (CHEMBL604844) Show SMILES CCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C12H17N5O5/c1-2-21-12-15-9(13)6-10(16-12)17(4-14-6)11-8(20)7(19)5(3-18)22-11/h4-5,7-8,11,18-20H,2-3H2,1H3,(H2,13,15,16)/t5-,7-,8-,11?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	7.94E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368259 (CHEMBL605673) Show SMILES Nc1nc(OCC2CCCCC2)nc2n(cnc12)C1O[C@@H](CO)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C17H25N5O5/c18-14-11-15(21-17(20-14)26-7-9-4-2-1-3-5-9)22(8-19-11)16-13(25)12(24)10(6-23)27-16/h8-10,12-13,16,23-25H,1-7H2,(H2,18,20,21)/t10-,12-,13-,16?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	5.01E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368260 (CHEMBL606510) Show SMILES CCCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C13H19N5O5/c1-2-3-22-13-16-10(14)7-11(17-13)18(5-15-7)12-9(21)8(20)6(4-19)23-12/h5-6,8-9,12,19-21H,2-4H2,1H3,(H2,14,16,17)/t6-,8-,9-,12?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.48E+5	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368261 (CHEMBL605247) Show SMILES Nc1nc(OCCC(=O)[C@H]2CC3CCC2C3)nc2n(cnc12)C1O[C@@H](CO)[C@H](O)[C@@H]1O |r,THB:7:9:15:13.12| Show InChI InChI=1S/C20H27N5O6/c21-17-14-18(25(8-22-14)19-16(29)15(28)13(7-26)31-19)24-20(23-17)30-4-3-12(27)11-6-9-1-2-10(11)5-9/h8-11,13,15-16,19,26,28-29H,1-7H2,(H2,21,23,24)/t9?,10?,11-,13-,15-,16-,19?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	8.71E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368244 (CHEMBL603379) Show SMILES CCCCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C14H21N5O5/c1-2-3-4-23-14-17-11(15)8-12(18-14)19(6-16-8)13-10(22)9(21)7(5-20)24-13/h6-7,9-10,13,20-22H,2-5H2,1H3,(H2,15,17,18)/t7-,9-,10-,13?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	3.72E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM25400 ((2R,3R,4S,5R)-2-[6-(cyclopentylamino)-9H-purin-9-y...) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC3CCCC3)ncnc12 Show InChI InChI=1S/C15H21N5O4/c21-5-9-11(22)12(23)15(24-9)20-7-18-10-13(16-6-17-14(10)20)19-8-3-1-2-4-8/h6-9,11-12,15,21-23H,1-5H2,(H,16,17,19)/t9-,11-,12-,15-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	12.6	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368264 (CHEMBL603588) Show SMILES Nc1nc(OCCCCC2CCCCC2)nc2n(cnc12)C1O[C@@H](CO)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C20H31N5O5/c21-17-14-18(25(11-22-14)19-16(28)15(27)13(10-26)30-19)24-20(23-17)29-9-5-4-8-12-6-2-1-3-7-12/h11-13,15-16,19,26-28H,1-10H2,(H2,21,23,24)/t13-,15-,16-,19?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	2.63E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368251 (CHEMBL605879) Show SMILES Nc1nc(OCCO)nc2n(cnc12)C1O[C@@H](CO)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C12H17N5O6/c13-9-6-10(16-12(15-9)22-2-1-18)17(4-14-6)11-8(21)7(20)5(3-19)23-11/h4-5,7-8,11,18-21H,1-3H2,(H2,13,15,16)/t5-,7-,8-,11?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	2.19E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368243 (CHEMBL605466) Show SMILES CCCCCCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C16H25N5O5/c1-2-3-4-5-6-25-16-19-13(17)10-14(20-16)21(8-18-10)15-12(24)11(23)9(7-22)26-15/h8-9,11-12,15,22-24H,2-7H2,1H3,(H2,17,19,20)/t9-,11-,12-,15?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.38E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368249 (CHEMBL605679) Show SMILES CCC(C)Oc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C14H21N5O5/c1-3-6(2)23-14-17-11(15)8-12(18-14)19(5-16-8)13-10(22)9(21)7(4-20)24-13/h5-7,9-10,13,20-22H,3-4H2,1-2H3,(H2,15,17,18)/t6?,7-,9-,10-,13?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	8.91E+5	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM21220 ((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	n/a	n/a	63.1	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368265 (CHEMBL604426) Show SMILES CC(C)Oc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C13H19N5O5/c1-5(2)22-13-16-10(14)7-11(17-13)18(4-15-7)12-9(21)8(20)6(3-19)23-12/h4-6,8-9,12,19-21H,3H2,1-2H3,(H2,14,16,17)/t6-,8-,9-,12?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	2.24E+5	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368262 (CHEMBL604429) Show SMILES CCC(CC)CCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C17H27N5O5/c1-3-9(4-2)5-6-26-17-20-14(18)11-15(21-17)22(8-19-11)16-13(25)12(24)10(7-23)27-16/h8-10,12-13,16,23-25H,3-7H2,1-2H3,(H2,18,20,21)/t10-,12-,13-,16?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.59E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368253 (CHEMBL603373) Show SMILES CC1(C)C2CC1C(CC2)C(=O)CCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C22H31N5O6/c1-22(2)10-3-4-11(12(22)7-10)13(29)5-6-32-21-25-18(23)15-19(26-21)27(9-24-15)20-17(31)16(30)14(8-28)33-20/h9-12,14,16-17,20,28,30-31H,3-8H2,1-2H3,(H2,23,25,26)/t10?,11?,12?,14-,16-,17-,20?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	4.47E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368250 (CHEMBL605254) Show SMILES Nc1nc(OCCCC2CCCCC2)nc2n(cnc12)C1O[C@@H](CO)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C19H29N5O5/c20-16-13-17(24(10-21-13)18-15(27)14(26)12(9-25)29-18)23-19(22-16)28-8-4-7-11-5-2-1-3-6-11/h10-12,14-15,18,25-27H,1-9H2,(H2,20,22,23)/t12-,14-,15-,18?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	3.72E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368263 (CHEMBL604223) Show SMILES CC(C)CCCOc1nc(N)c2ncn(C3O[C@@H](CO)[C@H](O)[C@@H]3O)c2n1 |r| Show InChI InChI=1S/C16H25N5O5/c1-8(2)4-3-5-25-16-19-13(17)10-14(20-16)21(7-18-10)15-12(24)11(23)9(6-22)26-15/h7-9,11-12,15,22-24H,3-6H2,1-2H3,(H2,17,19,20)/t9-,11-,12-,15?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	2.29E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50368258 (CHEMBL606093) Show SMILES Nc1nc(OCCC2CCCCC2)nc2n(cnc12)C1O[C@@H](CO)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C18H27N5O5/c19-15-12-16(22-18(21-15)27-7-6-10-4-2-1-3-5-10)23(9-20-12)17-14(26)13(25)11(8-24)28-17/h9-11,13-14,17,24-26H,1-8H2,(H2,19,21,22)/t11-,13-,14-,17?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	8.71E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM14487 ((2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxy...) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O Show InChI InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PDB PubMed	n/a	n/a	n/a	n/a	3.39E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair				3D Structure (crystal)
Adenosine receptor A1 (GUINEA PIG)	BDBM50367678 (CHEMBL605469) Show SMILES CC(C)N(c1ccccc1)c1ncnc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C19H23N5O4/c1-11(2)24(12-6-4-3-5-7-12)18-14-17(20-9-21-18)23(10-22-14)19-16(27)15(26)13(8-25)28-19/h3-7,9-11,13,15-16,19,25-27H,8H2,1-2H3/t13-,15-,16-,19?/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	33.9	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM82022 (2-(Phenylamino)ado (CV-1808) | 2-[6-Amino-2-(3-cyc...) Show SMILES Nc1nc(Nc2ccccc2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C16H18N6O4/c17-13-10-14(21-16(20-13)19-8-4-2-1-3-5-8)22(7-18-10)15-12(25)11(24)9(6-23)26-15/h1-5,7,9,11-12,15,23-25H,6H2,(H3,17,19,20,21)/t9-,11-,12-,15-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.26E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM82031 (2-Oxoado (isoguanosine) | CAS_1818-71-9 | isoguano...) Show SMILES Nc1[nH]c(=O)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H13N5O5/c11-7-4-8(14-10(19)13-7)15(2-12-4)9-6(18)5(17)3(1-16)20-9/h2-3,5-6,9,16-18H,1H2,(H3,11,13,14,19)/t3-,5-,6-,9-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.15E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50421886 (CHEMBL2311200) Show SMILES Nc1nc(OC2CCCC2)nc2n(cnc12)[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C15H21N5O5/c16-12-9-13(19-15(18-12)24-7-3-1-2-4-7)20(6-17-9)14-11(23)10(22)8(5-21)25-14/h6-8,10-11,14,21-23H,1-5H2,(H2,16,18,19)/t8-,10-,11-,14-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	7.94E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50421887 (CHEMBL2112181) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC(=O)[C@H]3C[C@H]4CC[C@@H]3C4)ncnc12 |r| Show InChI InChI=1S/C18H23N5O5/c24-5-11-13(25)14(26)18(28-11)23-7-21-12-15(19-6-20-16(12)23)22-17(27)10-4-8-1-2-9(10)3-8/h6-11,13-14,18,24-26H,1-5H2,(H,19,20,22,27)/t8-,9+,10-,11+,13+,14+,18+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	5.40	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM50364062 (CHEMBL1950555) Show SMILES COc1cc(OC)cc(c1)[C@@H](CNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccccc1C |r| Show InChI InChI=1S/C27H31N5O6/c1-15-6-4-5-7-19(15)20(16-8-17(36-2)10-18(9-16)37-3)11-28-25-22-26(30-13-29-25)32(14-31-22)27-24(35)23(34)21(12-33)38-27/h4-10,13-14,20-21,23-24,27,33-35H,11-12H2,1-3H3,(H,28,29,30)/t20-,21-,23-,24-,27-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	5.62E+3	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair
Adenosine receptor A1 (GUINEA PIG)	BDBM35804 ((CGS21680) 3-(4-{2-[6-Amino-9-(5-ethylcarbamoylmet...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCc3ccc(CCC(O)=O)cc3)nc12 Show InChI InChI=1S/C23H29N7O6/c1-2-25-21(35)18-16(33)17(34)22(36-18)30-11-27-15-19(24)28-23(29-20(15)30)26-10-9-13-5-3-12(4-6-13)7-8-14(31)32/h3-6,11,16-18,22,33-34H,2,7-10H2,1H3,(H,25,35)(H,31,32)(H3,24,26,28,29)/t16-,17+,18-,22+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	2.46E+4	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation				J Med Chem 34: 1334-9 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q23N240H
					More data for this Ligand-Target Pair