PD168,077 [Ligand Id: 975] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL45244 (PD-168077)
  • A2B receptor/Adenosine A2b receptor in Rat [ChEMBL: CHEMBL2592] [GtoPdb: 20] [UniProtKB: P29276]
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  • α2A-adrenoceptor/Alpha-2a adrenergic receptor in Rat [ChEMBL: CHEMBL327] [GtoPdb: 25] [UniProtKB: P22909]
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  • D3 receptor/Dopamine D3 receptor in Human [ChEMBL: CHEMBL234] [GtoPdb: 216] [UniProtKB: P35462]
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  • D4 receptor/Dopamine D4 receptor in Human [ChEMBL: CHEMBL219] [GtoPdb: 217] [UniProtKB: P21917]
  • D4 receptor in Rat [GtoPdb: 217] [UniProtKB: P30729]
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  • 5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Mouse [ChEMBL: CHEMBL3737] [GtoPdb: 1] [UniProtKB: Q64264]
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  • 5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Human [ChEMBL: CHEMBL224] [GtoPdb: 6] [UniProtKB: P28223]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
A2B receptor/Adenosine A2b receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2592] [GtoPdb: 20] [UniProtKB: P29276]
ChEMBL Binding affinity at Alpha-2 adrenergic receptor B 6.75 pKi 177 nM Ki J Med Chem (1997) 40: 1771-1772 [PMID:9191952]
α2A-adrenoceptor/Alpha-2a adrenergic receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL327] [GtoPdb: 25] [UniProtKB: P22909]
ChEMBL Binding affinity at alpha-1 adrenergic receptor B 6.77 pKi 168 nM Ki J Med Chem (1997) 40: 1771-1772 [PMID:9191952]
Dopamine D1 receptor in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2967] [UniProtKB: Q95136]
ChEMBL Affinity for Dopamine receptor D1 using [3H]SCH-23390 was carried out on bovine retinal membrane preparations B 5 pKi >10000 nM Ki J Med Chem (2003) 46: 161-168 [PMID:12502370]
D2 receptor/Dopamine D2 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL217] [GtoPdb: 215] [UniProtKB: P14416]
ChEMBL Binding affinity for human Dopamine receptor D2 expressed in CHO K1 transfected cells using [3H]spiperone as radioligand B 5.43 pKi 3740 nM Ki J Med Chem (1997) 40: 1771-1772 [PMID:9191952]
ChEMBL Binding affinity towards cloned human Dopamine receptor D2 B 5.43 pKi 3740 nM Ki Bioorg Med Chem Lett (2001) 11: 223-226 [PMID:11206464]
ChEMBL Binding affinity towards human dopamine receptor D2 was determined by using [3H]spiperone as radioligand B 5.55 pKi 2818.38 nM Ki Bioorg Med Chem Lett (2005) 15: 2149-2157 [PMID:15808487]
ChEMBL Displacement of [3H] Spiperone from human D2L receptor expressed in CHO cells by competitive radioligand binding assay B 5.64 pKi 2300 nM Ki J Med Chem (2019) 62: 9658-9679 [PMID:31613617]
ChEMBL Displacement of [3H] Spiperone from human D2S receptor expressed in CHO cells by competitive radioligand binding assay B 5.96 pKi 1100 nM Ki J Med Chem (2019) 62: 9658-9679 [PMID:31613617]
ChEMBL Antagonist activity at human recombinant D2 receptor expressed in HEK293 cells by FLIPR assay F 5 pIC50 >10000 nM IC50 J Med Chem (2006) 49: 5093-5109 [PMID:16913699]
ChEMBL Agonist activity at human recombinant D2 receptor expressed in HEK293 cells by FLIPR assay F 5 pEC50 >10000 nM EC50 J Med Chem (2006) 49: 5093-5109 [PMID:16913699]
Dopamine D2 receptor in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3998] [UniProtKB: P20288]
ChEMBL Affinity for Dopamine receptor D2 using [3H]-YM-09151-2 was carried out on bovine striatal membrane preparations B 4.74 pKi 18300 nM Ki J Med Chem (2003) 46: 161-168 [PMID:12502370]
ChEMBL Affinity for Dopamine receptor D2 using [3H]YM-09151-2 was carried out on bovine retinal membrane preparations (low-affinity) B 5.2 pKi 6300 nM Ki J Med Chem (2003) 46: 161-168 [PMID:12502370]
ChEMBL Affinity for Dopamine receptor D2 using [3H]YM-09151-2 was carried out on bovine retinal membrane preparations (high-affinity) B 7.6 pKi 25 nM Ki J Med Chem (2003) 46: 161-168 [PMID:12502370]
D3 receptor/Dopamine D3 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL234] [GtoPdb: 216] [UniProtKB: P35462]
ChEMBL Displacement of [3H] Spiperone from human D3 receptor expressed in CHO cells by competitive radioligand binding assay B 5.33 pKi 4700 nM Ki J Med Chem (2019) 62: 9658-9679 [PMID:31613617]
ChEMBL Binding affinity for human Dopamine receptor D3 expressed in CHO K1 transfected cells using [3H]spiperone as radioligand B 5.55 pKi 2810 nM Ki J Med Chem (1997) 40: 1771-1772 [PMID:9191952]
D4 receptor/Dopamine D4 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL219] [GtoPdb: 217] [UniProtKB: P21917]
ChEMBL Binding affinity towards human dopamine receptor D4 expressed in CHO cells was determined by using [3H]thymidine as radioligand B 7.77 pKi 16.98 nM Ki Bioorg Med Chem Lett (2005) 15: 2149-2157 [PMID:15808487]
ChEMBL Binding affinity towards cloned human Dopamine receptor D4 B 8.05 pKi 9 nM Ki Bioorg Med Chem Lett (2001) 11: 223-226 [PMID:11206464]
ChEMBL Binding affinity of compound towards human dopamine receptor D4 was determined B 8.06 pKi 8.71 nM Ki Bioorg Med Chem Lett (2005) 15: 2149-2157 [PMID:15808487]
ChEMBL Binding affinity for human Dopamine receptor D4 expressed in CHO K1 transfected cells using [3H]spiperone as radioligand B 8.06 pKi 8.7 nM Ki J Med Chem (1997) 40: 1771-1772 [PMID:9191952]
ChEMBL Displacement of [3H] Spiperone from human D4.4 receptor expressed in CHO cells by competitive radioligand binding assay B 8.64 pKi 2.3 nM Ki J Med Chem (2019) 62: 9658-9679 [PMID:31613617]
ChEMBL Agonist activation of human dopamine receptor stimulating mitogenesis in Dopamine receptor D4-transfected CHO pro-5 cells using [3H]thymidine as radioligand F 7.77 pEC50 17 nM EC50 J Med Chem (1997) 40: 1771-1772 [PMID:9191952]
ChEMBL Activity at human recombinant D4.4 receptor expressed in HEK293 cells by FLIPR assay F 8.08 pEC50 8.3 nM EC50 J Med Chem (2006) 49: 5093-5109 [PMID:16913699]
ChEMBL Agonist activity at human D4.4 receptor in HEK293 cells coexpressing G-alpha-qo5 by FLIPR F 8.08 pEC50 8.3 nM EC50 J Med Chem (2006) 49: 7450-7465 [PMID:17149874]
D4 receptor in Rat [GtoPdb: 217] [UniProtKB: P30729]
GtoPdb - - 8.8 pKi 1.58 nM Ki Mol Pharmacol (2004) 66: 1491-9 [PMID:15448188]
5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3737] [GtoPdb: 1] [UniProtKB: Q64264]
ChEMBL Binding affinity at 5-hydroxytryptamine 1A receptor B 6.41 pKi 385 nM Ki J Med Chem (1997) 40: 1771-1772 [PMID:9191952]
5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL224] [GtoPdb: 6] [UniProtKB: P28223]
ChEMBL Binding affinity at 5-hydroxytryptamine 2A receptor B 5.4 pKi 4010 nM Ki J Med Chem (1997) 40: 1771-1772 [PMID:9191952]

ChEMBL data shown on this page come from version 32:

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]