SB-282241 [Ligand Id: 782] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL432713 (TCMDC-139245)
  • CCR2/C-C chemokine receptor type 2 in Human [ChEMBL: CHEMBL4015] [GtoPdb: 59] [UniProtKB: P41597]
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  • CCR5/C-C chemokine receptor type 5 in Human [ChEMBL: CHEMBL274] [GtoPdb: 62] [UniProtKB: P51681]
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  • D2 receptor/Dopamine D2 receptor in Human [ChEMBL: CHEMBL217] [GtoPdb: 215] [UniProtKB: P14416]
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  • D3 receptor/Dopamine D3 receptor in Human [ChEMBL: CHEMBL234] [GtoPdb: 216] [UniProtKB: P35462]
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  • 5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Human [ChEMBL: CHEMBL214] [GtoPdb: 1] [UniProtKB: P08908]
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  • 5-HT1B receptor/Serotonin 1b (5-HT1b) receptor in Human [ChEMBL: CHEMBL1898] [GtoPdb: 2] [UniProtKB: P28222]
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  • 5-ht1e receptor/Serotonin 1e (5-HT1e) receptor in Human [ChEMBL: CHEMBL2182] [GtoPdb: 4] [UniProtKB: P28566]
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  • 5-HT1F receptor/Serotonin 1f (5-HT1f) receptor in Human [ChEMBL: CHEMBL1805] [GtoPdb: 5] [UniProtKB: P30939]
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  • 5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Human [ChEMBL: CHEMBL224] [GtoPdb: 6] [UniProtKB: P28223]
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  • 5-HT2B receptor/Serotonin 2b (5-HT2b) receptor in Human [ChEMBL: CHEMBL1833] [GtoPdb: 7] [UniProtKB: P41595]
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  • 5-HT2C receptor/Serotonin 2c (5-HT2c) receptor in Human [ChEMBL: CHEMBL225] [GtoPdb: 8] [UniProtKB: P28335]
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  • 5-HT6 receptor/Serotonin 6 (5-HT6) receptor in Human [ChEMBL: CHEMBL3371] [GtoPdb: 11] [UniProtKB: P50406]
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  • 5-HT7 receptor/Serotonin 7 (5-HT7) receptor in Human [ChEMBL: CHEMBL3155] [GtoPdb: 12] [UniProtKB: P34969]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
CCR2/C-C chemokine receptor type 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4015] [GtoPdb: 59] [UniProtKB: P41597]
ChEMBL Binding affinity of compound (10 uM) towards H121A receptor variant (mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 5.6 pKi 2511.89 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding affinity of compound (10 uM) towards Y210A-292A receptor variant (double mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 5.61 pKi 2454.71 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding affinity of compound (10 uM) towards H121A/T292A receptor variant (double mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 5.68 pKi 2089.3 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding affinity of compound (10 uM) towards T292A receptor variant (mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 6.14 pKi 724.44 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding affinity of compound (10 uM) towards Y1210A receptor variant (mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 6.25 pKi 562.34 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding affinity of compound (10 uM) towards D284A receptor variant (mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 6.64 pKi 229.09 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding affinity of compound (10 uM) towards Q288A receptor variant (mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 6.77 pKi 169.82 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding affinity of compound (10 uM) towards H121F receptor variant (mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 6.78 pKi 165.96 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding affinity of compound (10 uM) towards T290A receptor variant (mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 6.89 pKi 128.82 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
GtoPdb - - 7 pKi - - - J Med Chem (2003) 46: 4070-86 [PMID:12954060]
ChEMBL Binding affinity to CCR2 (unknown origin) assessed as inhibition constant B 7 pKi 100 nM Ki J Med Chem (2017) 60: 4735-4779 [PMID:28165741]
ChEMBL Binding affinity of compound (10 uM) towards WT receptor variant (mutant C-C chemokine receptor type 2) using radioligand [125I]MCP-1 in HEK 293 cells B 7 pKi 100 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding displacement of [125I]MCP-1 (0.14 nM) was measured on CHO cell membranes expressing human CCR2 (C-C chemokine receptor type 2) B 7.3 pKi 50.12 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Inhibition of [125I]MCP-1 binding to the cloned C-C chemokine receptor type 2B expressed in CHO cells B 7.3 pKi 50.12 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
ChEMBL Antagonist activity at human CCR2 receptor F 7.3 pKi 50.12 nM Ki Bioorg Med Chem Lett (2008) 18: 1450-1456 [PMID:18226895]
ChEMBL Displacement of [125I]MCP1 from human CCR2 expressed in CHO cells B 7.3 pKi 50 nM Ki Bioorg Med Chem Lett (2006) 16: 3735-3739 [PMID:16698264]
ChEMBL Antagonist activity at human CCR2 receptor F 7.3 pKi 50 nM Ki Bioorg Med Chem Lett (2008) 18: 1450-1456 [PMID:18226895]
ChEMBL Antagonist activity against C-C chemokine receptor type 2 F 7.3 pKi 50 nM Ki Bioorg Med Chem Lett (2000) 10: 1803-1806 [PMID:10969972]
ChEMBL Inhibition of [125I]MCP-1 binding to the cloned C-C chemokine receptor type 2B expressed in CHO cells B 7.3 pKi 50 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
ChEMBL Binding affinity at C-C chemokine receptor type 2 was determined B 7.3 pKi 50 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Binding affinity of compound (10 uM) towards Y49F receptor variant (mutant CCR2 receptor) using radioligand [125I]MCP-1 in HEK 293 cells B 7.78 pKi 16.6 nM Ki J Med Chem (2003) 46: 4070-4086 [PMID:12954060]
ChEMBL Inhibition of wild type CCR2 mutant (unknown origin) B 7 pIC50 100 nM IC50 J Med Chem (2017) 60: 4735-4779 [PMID:28165741]
CCR5/C-C chemokine receptor type 5 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL274] [GtoPdb: 62] [UniProtKB: P51681]
ChEMBL Compound was evaluated for the antagonist activity against C-C chemokine receptor type 5 F 5.37 pKi 4260 nM Ki Bioorg Med Chem Lett (2000) 10: 1803-1806 [PMID:10969972]
D2 receptor/Dopamine D2 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL217] [GtoPdb: 215] [UniProtKB: P14416]
ChEMBL Binding affinity for Dopamine receptor D2 was determined B 7.8 pKi 15.85 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
D3 receptor/Dopamine D3 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL234] [GtoPdb: 216] [UniProtKB: P35462]
ChEMBL Binding affinity for Dopamine receptor D3 was determined B 8.1 pKi 7.94 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL214] [GtoPdb: 1] [UniProtKB: P08908]
ChEMBL Binding affinity for 5-hydroxytryptamine 1A receptor was determined B 7 pKi 100 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
5-HT1B receptor/Serotonin 1b (5-HT1b) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1898] [GtoPdb: 2] [UniProtKB: P28222]
ChEMBL Binding affinity for 5-hydroxytryptamine 1B receptor was determined B 7.9 pKi 12.59 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
5-ht1e receptor/Serotonin 1e (5-HT1e) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2182] [GtoPdb: 4] [UniProtKB: P28566]
ChEMBL Binding affinity for 5-hydroxytryptamine 1E receptor was determined B 8.2 pKi 6.31 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
5-HT1F receptor/Serotonin 1f (5-HT1f) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1805] [GtoPdb: 5] [UniProtKB: P30939]
ChEMBL Binding affinity for 5-hydroxytryptamine 1F receptor was determined B 8.5 pKi 3.16 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL224] [GtoPdb: 6] [UniProtKB: P28223]
ChEMBL Binding affinity for 5-hydroxytryptamine 2A receptor was determined B 7.7 pKi 19.95 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
5-HT2B receptor/Serotonin 2b (5-HT2b) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1833] [GtoPdb: 7] [UniProtKB: P41595]
ChEMBL Binding affinity for 5-hydroxytryptamine 2B receptor was determined B 7.6 pKi 25.12 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
5-HT2C receptor/Serotonin 2c (5-HT2c) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL225] [GtoPdb: 8] [UniProtKB: P28335]
ChEMBL Binding affinity for 5-hydroxytryptamine 2C receptor was determined B 7.1 pKi 79.43 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
5-HT6 receptor/Serotonin 6 (5-HT6) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3371] [GtoPdb: 11] [UniProtKB: P50406]
ChEMBL Binding affinity for 5-hydroxytryptamine 6 receptor was determined B 7.1 pKi 79.43 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]
5-HT7 receptor/Serotonin 7 (5-HT7) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3155] [GtoPdb: 12] [UniProtKB: P34969]
ChEMBL Binding affinity for 5-hydroxytryptamine 7 receptor was determined B 7.2 pKi 63.1 nM Ki Bioorg Med Chem Lett (2001) 11: 2177-2180 [PMID:11514164]

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]