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 adenosine A3R (unknown origin) | B | 9.26 | pKd | 0.55 | nM | Kd | J Med Chem (2022) 65: 13305-13327 [PMID:36173355] |
| 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 34:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
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]
