Compile Data Set for Download or QSAR

Found 1043 hits with Last Name = 'metzger' and Initial = 'e'   

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 A2a (Homo sapiens (Human))	BDBM471619 ((R)-7-methoxy-2-(1-(3,3,3- trifluoro-2- (trifluoro...) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC(C(F)(F)F)C(F)(F)F)C1 |r| Show InChI InChI=1S/C19H20F6N6O/c1-32-12-6-2-5-11-14(12)27-17(26)31-16(11)28-15(29-31)10-4-3-7-30(8-10)9-13(18(20,21)22)19(23,24)25/h2,5-6,10,13H,3-4,7-9H2,1H3,(H2,26,27)/t10-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471689 (US10822338, Example 58B) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CCC(F)(F)CN1 |r| Show InChI InChI=1S/C15H16F2N6O/c1-24-10-4-2-3-8-11(10)20-14(18)23-13(8)21-12(22-23)9-5-6-15(16,17)7-19-9/h2-4,9,19H,5-7H2,1H3,(H2,18,20)/t9-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471691 (US10822338, Example 35C) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CC2CC[C@@H]1N(CC(F)(F)F)C2 |r,THB:23:22:16.17:20.19| Show InChI InChI=1S/C19H21F3N6O/c1-29-14-4-2-3-11-15(14)24-18(23)28-17(11)25-16(26-28)12-7-10-5-6-13(12)27(8-10)9-19(20,21)22/h2-4,10,12-13H,5-9H2,1H3,(H2,23,24)/t10?,12-,13+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471642 (US10822338, Example 24B) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C[C@H](C2CC2)C(F)(F)F)C1 |r| Show InChI InChI=1S/C21H25F3N6O/c1-31-16-6-2-5-14-17(16)26-20(25)30-19(14)27-18(28-30)13-4-3-9-29(10-13)11-15(12-7-8-12)21(22,23)24/h2,5-6,12-13,15H,3-4,7-11H2,1H3,(H2,25,26)/t13-,15-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471649 (US10822338, Example 29C) Show SMILES Nc1nc2c(O)cccc2c2nc(nn12)[C@@H]1CCC[C@@H](CCC(F)(F)F)C1 |r| Show InChI InChI=1S/C18H20F3N5O/c19-18(20,21)8-7-10-3-1-4-11(9-10)15-24-16-12-5-2-6-13(27)14(12)23-17(22)26(16)25-15/h2,5-6,10-11,27H,1,3-4,7-9H2,(H2,22,23)/t10-,11+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471628 ((R)-7-methoxy-2-(1- (3,3,4,4,4- pentafluorobutyl)p...) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CCC(F)(F)C(F)(F)F)C1 |r| Show InChI InChI=1S/C19H21F5N6O/c1-31-13-6-2-5-12-14(13)26-17(25)30-16(12)27-15(28-30)11-4-3-8-29(10-11)9-7-18(20,21)19(22,23)24/h2,5-6,11H,3-4,7-10H2,1H3,(H2,25,26)/t11-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471620 ((R)-2-(1-(2,2- difluoroethyl)piperidin-3- yl)-7-me...) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC(F)F)C1 |r| Show InChI InChI=1S/C17H20F2N6O/c1-26-12-6-2-5-11-14(12)21-17(20)25-16(11)22-15(23-25)10-4-3-7-24(8-10)9-13(18)19/h2,5-6,10,13H,3-4,7-9H2,1H3,(H2,20,21)/t10-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471641 (US10822338, Example 24A) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C[C@@H](C2CC2)C(F)(F)F)C1 |r| Show InChI InChI=1S/C21H25F3N6O/c1-31-16-6-2-5-14-17(16)26-20(25)30-19(14)27-18(28-30)13-4-3-9-29(10-13)11-15(12-7-8-12)21(22,23)24/h2,5-6,12-13,15H,3-4,7-11H2,1H3,(H2,25,26)/t13-,15+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471687 (US10822338, Example 57) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CC(F)(F)CN1 |r| Show InChI InChI=1S/C14H14F2N6O/c1-23-9-4-2-3-7-10(9)19-13(17)22-12(7)20-11(21-22)8-5-14(15,16)6-18-8/h2-4,8,18H,5-6H2,1H3,(H2,17,19)/t8-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471618 (US10822338, Example 1) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CCC(F)(F)F)C1 |r| Show InChI InChI=1S/C18H21F3N6O/c1-28-13-6-2-5-12-14(13)23-17(22)27-16(12)24-15(25-27)11-4-3-8-26(10-11)9-7-18(19,20)21/h2,5-6,11H,3-4,7-10H2,1H3,(H2,22,23)/t11-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471670 (US10822338, Example 43) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC(C)(C)F)C1 |r| Show InChI InChI=1S/C19H25FN6O/c1-19(2,20)11-25-9-5-6-12(10-25)16-23-17-13-7-4-8-14(27-3)15(13)22-18(21)26(17)24-16/h4,7-8,12H,5-6,9-11H2,1-3H3,(H2,21,22)/t12-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471634 ((R)-2-(1-((3,3- difluorocyclobutyl)methyl) piperid...) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC2CC(F)(F)C2)C1 |r| Show InChI InChI=1S/C20H24F2N6O/c1-29-15-6-2-5-14-16(15)24-19(23)28-18(14)25-17(26-28)13-4-3-7-27(11-13)10-12-8-20(21,22)9-12/h2,5-6,12-13H,3-4,7-11H2,1H3,(H2,23,24)/t13-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471656 (US10822338, Example 32A) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@H]1CCCCN(CC(F)(F)F)C1 |r| Show InChI InChI=1S/C18H21F3N6O/c1-28-13-7-4-6-12-14(13)23-17(22)27-16(12)24-15(25-27)11-5-2-3-8-26(9-11)10-18(19,20)21/h4,6-7,11H,2-3,5,8-10H2,1H3,(H2,22,23)/t11-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508614 (8-(2-{(cyclopropylmethyl)[(4- methyl-1,3-thiazol-2...) Show SMILES Cc1csc(CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CC2CC2)n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508706 (US11046714, Example 140 | US11046714, Example 141) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)C1CCCN(CCC(F)(F)F)C1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471639 ((R)-7-methoxy-2-(1-(5- methylthiazol-2- yl)piperid...) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)c1ncc(C)s1 |r| Show InChI InChI=1S/C19H21N7OS/c1-11-9-21-19(28-11)25-8-4-5-12(10-25)16-23-17-13-6-3-7-14(27-2)15(13)22-18(20)26(17)24-16/h3,6-7,9,12H,4-5,8,10H2,1-2H3,(H2,20,22)/t12-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471640 (US10822338, Example 23) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(CC(F)(F)F)C1 |r| Show InChI InChI=1S/C17H19F3N6O/c1-27-12-6-2-5-11-13(12)22-16(21)26-15(11)23-14(24-26)10-4-3-7-25(8-10)9-17(18,19)20/h2,5-6,10H,3-4,7-9H2,1H3,(H2,21,22)/t10-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508593 (4-[2-(5-amino-2,2-difluoro[1,3] dioxolo[4,5-h][1,2...) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCN(CC4CC4)C(=O)C3)nn12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471685 (US10822338, Example 56A) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@H]1CCCN(CCC(F)(F)F)C1 |r| Show InChI InChI=1S/C18H17F5N6O2/c19-17(20,21)5-7-28-6-1-2-9(8-28)14-26-15-10-3-4-11-13(31-18(22,23)30-11)12(10)25-16(24)29(15)27-14/h3-4,9H,1-2,5-8H2,(H2,24,25)/t9-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471677 (US10822338, Example 50A) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)C1CCCN(C1)c1ccccc1 Show InChI InChI=1S/C21H22N6O/c1-28-17-11-5-10-16-18(17)23-21(22)27-20(16)24-19(25-27)14-7-6-12-26(13-14)15-8-3-2-4-9-15/h2-5,8-11,14H,6-7,12-13H2,1H3,(H2,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508630 (US11046714, Example 72 | US11046714, Example 73) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCCC(F)(C3)C(F)(F)F)nn12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508537 (8-[2-(2-cyclopropyl-6,7- dihydro[1,3]oxazolo[5,4- ...) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCc4nc(oc4C3)C3CC3)nn12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508630 (US11046714, Example 72 | US11046714, Example 73) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCCC(F)(C3)C(F)(F)F)nn12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508611 (2,2-difluoro-8-(2-{[1- (trifluoromethyl)cyclobutyl...) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCNC3(CCC3)C(F)(F)F)nn12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508704 (US11046714, Example 138) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@@H]1CCCN(CC(F)(F)F)C1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508693 (8-[(3,5-dimethyl-1H-pyrazol-1-yl) methyl]-2,2-difl...) Show SMILES Cc1cc(C)n(Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508599 (4-[2-(5-amino-2,2-difluoro[1,3] dioxolo[4,5-h][1,2...) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCN(C(=O)C3)c3cccc(F)c3)nn12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508553 (8-{2-[(2R)-4,4-difluoro-2- methylpyrrolidin-1-yl]e...) Show SMILES C[C@@H]1CC(F)(F)CN1CCc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508689 (2,2-difluoro-8-({[1-(trifluoromethyl) cyclobutyl]a...) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CNC3(CCC3)C(F)(F)F)nn12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471669 (US10822338, Example 42) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C(=O)C(C)(C)F |r| Show InChI InChI=1S/C19H23FN6O2/c1-19(2,20)17(27)25-9-5-6-11(10-25)15-23-16-12-7-4-8-13(28-3)14(12)22-18(21)26(16)24-15/h4,7-8,11H,5-6,9-10H2,1-3H3,(H2,21,22)/t11-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471660 (US10822338, Example 34A | US10822338, Example 34B) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CN(CC(F)F)CC(F)(F)C1 |r| Show InChI InChI=1S/C17H18F4N6O/c1-28-11-4-2-3-10-13(11)23-16(22)27-15(10)24-14(25-27)9-5-17(20,21)8-26(6-9)7-12(18)19/h2-4,9,12H,5-8H2,1H3,(H2,22,23)/t9-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471663 (US10822338, Example 36) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C21H22N6O3S/c1-30-17-11-5-10-16-18(17)23-21(22)27-20(16)24-19(25-27)14-7-6-12-26(13-14)31(28,29)15-8-3-2-4-9-15/h2-5,8-11,14H,6-7,12-13H2,1H3,(H2,22,23)/t14-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471680 (US10822338, Example 52) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C1CC1 |r| Show InChI InChI=1S/C18H22N6O/c1-25-14-6-2-5-13-15(14)20-18(19)24-17(13)21-16(22-24)11-4-3-9-23(10-11)12-7-8-12/h2,5-6,11-12H,3-4,7-10H2,1H3,(H2,19,20)/t11-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508651 (8-[(2R or 2S)-2-(5,7-dihydro-6H- pyrrolo[3,4-b]pyr...) Show SMILES CC(Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1Cc2cccnc2C1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471643 (US10822338, Example 25) Show SMILES Nc1nc2c(OC(F)F)cccc2c2nc(nn12)[C@@H]1CCCN(CC(F)F)C1 |r| Show InChI InChI=1S/C17H18F4N6O/c18-12(19)8-26-6-2-3-9(7-26)14-24-15-10-4-1-5-11(28-16(20)21)13(10)23-17(22)27(15)25-14/h1,4-5,9,12,16H,2-3,6-8H2,(H2,22,23)/t9-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508625 ((R or S)-8-[2-(3,3-difluoro-2- methylpiperidin-1-y...) Show SMILES C[C@H]1N(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CCCC1(F)F |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508710 ((R or S)-8-[1-(3,5-difluorophenyl) piperidin-3-yl]...) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)C1CCCN(C1)c1cc(F)cc(F)c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508708 (US11046714, Example 142 | US11046714, Example 143) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)C1CCCN(C1)c1cccc(F)c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508638 (2,2-difluoro-8-[(2R)-2-(2-methyl- 6,7-dihydro[1,3]...) Show SMILES C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2nc(C)oc2C1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471644 (US10822338, Example 26) Show SMILES Nc1nc2cc(Cl)ccc2c2nc(nn12)[C@@H]1CCCN(CC(F)F)C1 |r| Show InChI InChI=1S/C16H17ClF2N6/c17-10-3-4-11-12(6-10)21-16(20)25-15(11)22-14(23-25)9-2-1-5-24(7-9)8-13(18)19/h3-4,6,9,13H,1-2,5,7-8H2,(H2,20,21)/t9-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471664 (US10822338, Example 37) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)[C@@H]1CCCN(C1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C22H22N6O2/c1-30-17-11-5-10-16-18(17)24-22(23)28-20(16)25-19(26-28)15-9-6-12-27(13-15)21(29)14-7-3-2-4-8-14/h2-5,7-8,10-11,15H,6,9,12-13H2,1H3,(H2,23,24)/t15-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508675 (2,2-difluoro-8-[(3-fluoro-3- methylazetidin-1-yl)m...) Show SMILES CC1(F)CN(Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)C1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508678 (2,2-difluoro-8-{[3-fluoro-3- (trifluoromethyl)azet...) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CN3CC(F)(C3)C(F)(F)F)nn12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508691 (8-({(cyclopropylmethyl)[(4-methyl-1,3- thiazol-2-y...) Show SMILES Cc1csc(CN(CC2CC2)Cc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508636 (8-[(2R)-2-(5,8-dihydro-1,7- naphthyridin-7(6H)-yl)...) Show SMILES C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2cccnc2C1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM471679 (US10822338, Example 51) Show SMILES COc1cccc2c3nc(nn3c(N)nc12)C1CCN(C1)c1cccc(F)c1 Show InChI InChI=1S/C20H19FN6O/c1-28-16-7-3-6-15-17(16)23-20(22)27-19(15)24-18(25-27)12-8-9-26(11-12)14-5-2-4-13(21)10-14/h2-7,10,12H,8-9,11H2,1H3,(H2,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2A receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10822338 (2020) BindingDB Entry DOI: 10.7270/Q2KS6VMH
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508552 (8-[2-(3,3-difluoropyrrolidin-1- yl)ethyl]-2,2-difl...) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(CCN3CCC(F)(F)C3)nn12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508642 (2,2-difluoro-8-[(2R)-2-(2-methyl- 6,7-dihydro[1,3]...) Show SMILES C[C@H](Cc1nc2c3ccc4OC(F)(F)Oc4c3nc(N)n2n1)N1CCc2sc(C)nc2C1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508705 (US11046714, Example 139) Show SMILES Nc1nc2c3OC(F)(F)Oc3ccc2c2nc(nn12)[C@@H]1CCCN(CC(F)F)C1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM508616 (8-(2-{(cyclopropylmethyl)[(2- methyl-1,3-thiazol-5...) Show SMILES Cc1ncc(CN(CCc2nc3c4ccc5OC(F)(F)Oc5c4nc(N)n3n2)CC2CC2)s1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The following table shows representative data for the compounds of the Examples as A2a receptor antagonists as determined by a competition binding as...				Citation and Details BindingDB Entry DOI: 10.7270/Q28S4T2C
					More data for this Ligand-Target Pair

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