MRE 3008F20 [Ligand Id: 459] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL302765 |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| A1 receptor/Adenosine A1 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL226] [GtoPdb: 18] [UniProtKB: P30542] | ||||||||
| ChEMBL | Inhibition of [3H]DPCPX binding to human Adenosine A1 receptor expressed in CHO cells; Range 1030-1400 | B | 5.92 | pKi | 1200 | nM | Ki | J Med Chem (2002) 45: 3703-3708 [PMID:12166943] |
| ChEMBL | Displacement of [3H]DPCPX from human Adenosine A1 receptor expressed in CHO cells | B | 5.92 | pKi | 1197 | nM | Ki | J Med Chem (1999) 42: 4473-4478 [PMID:10579811] |
| ChEMBL | Tested for inhibitory activity against human adenosine A1 receptor by displacement of [3H]DPCPX expressed in CHO cells; value ranges from 1027-1396 | B | 5.92 | pKi | 1197 | nM | Ki | J Med Chem (2000) 43: 4768-4780 [PMID:11123985] |
| ChEMBL | Displacement of [3H]DPCPX from human Adenosine A1 receptor in CHO cells | B | 5.92 | pKi | 1197 | nM | Ki | J Med Chem (2001) 44: 2735-2742 [PMID:11495585] |
| ChEMBL | Binding affinity against human Adenosine A1 receptor in CHO cells | B | 5.92 | pKi | 1197 | nM | Ki | Bioorg Med Chem Lett (2000) 10: 209-211 [PMID:10698437] |
| ChEMBL | Displacement of [3H]DPCPX from human Adenosine A1 receptor expressed in CHO cells; range 1027-1396 | B | 5.92 | pKi | 1197 | nM | Ki | J Med Chem (2002) 45: 770-780 [PMID:11831890] |
| ChEMBL | Displacement of [3H]-DPCPX from human adenosine A1 receptor expressed in CHO cells | B | 5.96 | pKi | 1100 | nM | Ki | Bioorg Med Chem (2012) 20: 1046-1059 [PMID:22204739] |
| ChEMBL | Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation counter | B | 5.96 | pKi | 1100 | nM | Ki | J Med Chem (2012) 55: 5380-5390 [PMID:22568637] |
| GtoPdb | - | - | 6 | pKi | - | - | - |
Biochem Pharmacol (2005) 70: 1601-12 [PMID:16219300]; Mol Pharmacol (2000) 57: 968-75 [PMID:10779381]; Nat Rev Drug Discov (2006) 5: 247-64 [PMID:16518376] |
| A1 receptor/Adenosine A1 receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL318] [GtoPdb: 18] [UniProtKB: P25099] | ||||||||
| ChEMBL | Displacement of [3H]DPCPX from Adenosine A1 receptor of rat brain membranes | B | 5 | pKi | >10000 | nM | Ki | J Med Chem (1999) 42: 4473-4478 [PMID:10579811] |
| A2A receptor/Adenosine A2a receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL251] [GtoPdb: 19] [UniProtKB: P29274] | ||||||||
| GtoPdb | - | - | 6.8 | pKi | - | - | - |
Biochem Pharmacol (2005) 70: 1601-12 [PMID:16219300]; Mol Pharmacol (2000) 57: 968-75 [PMID:10779381]; Nat Rev Drug Discov (2006) 5: 247-64 [PMID:16518376] |
| ChEMBL | Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells | B | 6.85 | pKi | 141.25 | nM | Ki | Bioorg Med Chem (2009) 17: 5259-5274 [PMID:19501513] |
| ChEMBL | Binding affinity against human Adenosine A2A receptor in CHO cells | B | 6.85 | pKi | 141 | nM | Ki | Bioorg Med Chem Lett (2000) 10: 209-211 [PMID:10698437] |
| ChEMBL | Displacement of specific [3H]-SCH- 58261 binding at human Adenosine A2A receptor expressed in HEK293 cells | B | 6.85 | pKi | 141 | nM | Ki | J Med Chem (1999) 42: 4473-4478 [PMID:10579811] |
| ChEMBL | Displacement of [3H]ZM241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation counter | B | 6.85 | pKi | 141 | nM | Ki | J Med Chem (2012) 55: 5380-5390 [PMID:22568637] |
| ChEMBL | Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells | B | 6.85 | pKi | 140 | nM | Ki | Bioorg Med Chem (2009) 17: 5259-5274 [PMID:19501513] |
| ChEMBL | Displacement of [3H]-SCH 58261 from human adenosine A2A receptor expressed in CHO cells | B | 6.85 | pKi | 140 | nM | Ki | Bioorg Med Chem (2012) 20: 1046-1059 [PMID:22204739] |
| ChEMBL | Inhibition of [3H]CGS-21680 binding to human Adenosine A2A receptor expressed in HEK293 cells; Range 120-155 | B | 6.85 | pKi | 140 | nM | Ki | J Med Chem (2002) 45: 3703-3708 [PMID:12166943] |
| ChEMBL | Displacement of [3H]-SCH- 58261 from human adenosine A2A receptor expressed in CHO cells; range 120-155 | B | 6.85 | pKi | 140 | nM | Ki | J Med Chem (2000) 43: 4768-4780 [PMID:11123985] |
| ChEMBL | Displacement of [3H]SCH-58261 from human Adenosine A2A receptor expressed in CHO cells | B | 6.85 | pKi | 140 | nM | Ki | J Med Chem (2001) 44: 2735-2742 [PMID:11495585] |
| ChEMBL | Displacement of [3H]SCH-58261 from human Adenosine A2A receptor expressed in HEK293 cells; range 120-155 | B | 6.85 | pKi | 140 | nM | Ki | J Med Chem (2002) 45: 770-780 [PMID:11831890] |
| A2A receptor/Adenosine A2a receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL302] [GtoPdb: 19] [UniProtKB: P30543] | ||||||||
| ChEMBL | Displacement of [3H]-SCH- 58261 from Adenosine A2A receptor in rat striatal membranes | B | 5.7 | pKi | 1993 | nM | Ki | J Med Chem (1999) 42: 4473-4478 [PMID:10579811] |
| A2B receptor/Adenosine A2b receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL255] [GtoPdb: 20] [UniProtKB: P29275] | ||||||||
| ChEMBL | Displacement of [3H]-DPCPX from human adenosine A2B receptor expressed in HEK293 cells after 60 mins | B | 5.68 | pKi | 2100 | nM | Ki | Bioorg Med Chem (2012) 20: 1046-1059 [PMID:22204739] |
| ChEMBL | Antagonist activity at human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-induced cAMP production | F | 5.68 | pKi | 2100 | nM | Ki | J Med Chem (2012) 55: 5380-5390 [PMID:22568637] |
| ChEMBL | Displacement of [3H]DPCPX from human Adenosine A2B receptor expressed in HEK293 cells; range 1637-2582 | B | 5.69 | pKi | 2056 | nM | Ki | J Med Chem (2002) 45: 770-780 [PMID:11831890] |
| ChEMBL | Displacement of [3H]DPCPX from Adenosine A2b receptor expressed in CHO cells; range 1637-2582 | B | 5.69 | pKi | 2056 | nM | Ki | J Med Chem (2000) 43: 4768-4780 [PMID:11123985] |
| ChEMBL | Displacement of [3H]DPCPX from human Adenosine A2B receptor expressed in HEK293 cells | B | 5.69 | pKi | 2056 | nM | Ki | J Med Chem (2001) 44: 2735-2742 [PMID:11495585] |
| ChEMBL | Inhibition of [3H]DPCPX binding to human Adenosine A2B receptor expressed in HEK cells; Range 1640-2580 | B | 5.69 | pKi | 2056 | nM | Ki | J Med Chem (2002) 45: 3703-3708 [PMID:12166943] |
| GtoPdb | - | - | 5.8 | pKi | - | - | - |
Biochem Pharmacol (2005) 70: 1601-12 [PMID:16219300]; Mol Pharmacol (2000) 57: 968-75 [PMID:10779381]; Nat Rev Drug Discov (2006) 5: 247-64 [PMID:16518376] |
| A3 receptor/Adenosine A3 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL256] [GtoPdb: 21] [UniProtKB: P0DMS8] | ||||||||
| ChEMBL | Binding affinity to human adenosine A3 receptor measured by radioligand binding assay | B | 5.95 | pKi | 1130 | nM | Ki | ACS Med Chem Lett (2022) 13: 623-631 [PMID:35450351] |
| ChEMBL | Displacement of [3H]MRE3008-F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins | B | 6.22 | pKi | 602.56 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 818-823 [PMID:21163647] |
| GtoPdb | - | - | 8 | pKi | - | - | - | Mol Pharmacol (2000) 57: 968-75 [PMID:10779381] |
| ChEMBL | Displacement of [3H]MRE3008-F20 from human Adenosine A3 receptor expressed in CHO cells | B | 9.1 | pKi | 0.8 | nM | Ki | J Med Chem (2001) 44: 2735-2742 [PMID:11495585] |
| ChEMBL | Inhibition of [125I]AB-MECA binding to human Adenosine A3 receptor expressed in HEK cells; Range 0.63-1.00 | B | 9.1 | pKi | 0.8 | nM | Ki | J Med Chem (2002) 45: 3703-3708 [PMID:12166943] |
| ChEMBL | Binding affinity for human adenosine A3 receptor | B | 9.1 | pKi | 0.8 | nM | Ki | J Med Chem (2005) 48: 152-162 [PMID:15634009] |
| ChEMBL | Displacement of [3H]MRE3008-F20 from human Adenosine A3 receptor expressed in HEK cells; range 0.63-1.0 | B | 9.1 | pKi | 0.8 | nM | Ki | J Med Chem (2002) 45: 770-780 [PMID:11831890] |
| ChEMBL | Displacement of [3H]MRE3008-F20 from human adenosine A3 receptor expressed in CHO cells; range 0.63-0.1.00 | B | 9.1 | pKi | 0.8 | nM | Ki | J Med Chem (2000) 43: 4768-4780 [PMID:11123985] |
| ChEMBL | Displacement of [3H]NECA from human adenosine A3 receptor expressed in CHO cells | B | 9.1 | pKi | 0.8 | nM | Ki | Bioorg Med Chem (2009) 17: 5259-5274 [PMID:19501513] |
| ChEMBL | Binding affinity to human adenosine A3 receptor | B | 9.1 | pKi | 0.8 | nM | Ki | Med Chem Res (2013) null: 1-10 |
| ChEMBL | Displacement of [3H]NECA from human adenosine A3 receptor expressed in CHO cells | B | 9.1 | pKi | 0.79 | nM | Ki | Bioorg Med Chem (2009) 17: 5259-5274 [PMID:19501513] |
| GtoPdb | - | - | 9.5 | pKi | - | - | - |
Biochem Pharmacol (2005) 70: 1601-12 [PMID:16219300]; Mol Pharmacol (2000) 57: 968-75 [PMID:10779381]; Nat Rev Drug Discov (2006) 5: 247-64 [PMID:16518376] |
| ChEMBL | Binding affinity against human Adenosine A3 receptor in CHO cells | B | 9.54 | pKi | 0.29 | nM | Ki | Bioorg Med Chem Lett (2000) 10: 209-211 [PMID:10698437] |
| ChEMBL | Displacement of [3H]MRE-3008-F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation counter | B | 9.54 | pKi | 0.29 | nM | Ki | J Med Chem (2012) 55: 5380-5390 [PMID:22568637] |
| ChEMBL | Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells | B | 9.54 | pKi | 0.29 | nM | Ki | J Med Chem (2006) 49: 4085-4097 [PMID:16821770] |
| ChEMBL | Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells | B | 9.54 | pKi | 0.29 | nM | Ki | Bioorg Med Chem (2012) 20: 1046-1059 [PMID:22204739] |
| ChEMBL | Displacement of [125]AB-MECA from human Adenosine A3 receptor expressed in HEK293 cells | B | 9.54 | pKi | 0.29 | nM | Ki | J Med Chem (1999) 42: 4473-4478 [PMID:10579811] |
| ChEMBL | Inhibition of cAMP accumulation in CHO cells expressing human adenosine A3 receptor; range 4.4-6.5 | F | 8.28 | pIC50 | 5.2 | nM | IC50 | J Med Chem (2000) 43: 4768-4780 [PMID:11123985] |
| ChEMBL | Inhibitory concentration as antagonistic activity against cAMP generation inhibited by IB-MECA in CHO cell membranes transfected with human Adenosine A3 receptor | F | 8.35 | pIC50 | 4.5 | nM | IC50 | J Med Chem (1999) 42: 4473-4478 [PMID:10579811] |
| A3 receptor/Adenosine A3 receptor in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075269] [GtoPdb: 21] [UniProtKB: Q61618] | ||||||||
| ChEMBL | Binding affinity to mouse adenosine A3 receptor measured by radioligand binding assay | B | 5 | pKi | >10000 | nM | Ki | ACS Med Chem Lett (2022) 13: 623-631 [PMID:35450351] |
| A3 receptor/Adenosine A3 receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3360] [GtoPdb: 21] [UniProtKB: P28647] | ||||||||
| ChEMBL | Binding affinity to rat adenosine A3 receptor measured by radioligand binding assay | B | 5 | pKi | >10000 | nM | Ki | ACS Med Chem Lett (2022) 13: 623-631 [PMID:35450351] |
ChEMBL data shown on this page come from version 33:
Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]
