relcovaptan [Ligand Id: 2200] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL419667 (Relcovaptan, Sr-49059, SR 49059, TDI 0134, TDI-0134) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| V1A receptor/Vasopressin V1a receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1889] [GtoPdb: 366] [UniProtKB: P37288] | ||||||||
| ChEMBL | Binding affinity to vasopressin V1a receptor | B | 8.7 | pKi | 2 | nM | Ki | J Nat Prod (1994) 57: 1329-1335 [PMID:7807119] |
| ChEMBL | Inhibition of human vasopressin V1a receptor expressed in CHO cells by polarisation binding assay using 384-well plate membranes | B | 8.83 | pKi | 1.48 | nM | Ki | J Med Chem (2007) 50: 4976-4985 [PMID:17850055] |
| ChEMBL | Displacement of [Se-Se]-AVP from human V1A receptor expressed in CHO cells after 4 hrs by RP-LC-ICPMS analysis | B | 9.05 | pKi | 0.9 | nM | Ki | J Med Chem (2018) 61: 10173-10184 [PMID:30395477] |
| ChEMBL | Inhibition of human vasopressin V1a receptor expressed in COS7 cells by HTRF-FRET assay using 96-well plate cells | B | 9.07 | pKi | 0.85 | nM | Ki | J Med Chem (2007) 50: 4976-4985 [PMID:17850055] |
| ChEMBL | Inhibition of human vasopressin V1a receptor expressed in CHO cells by polarisation binding assay using 96-well plate membranes | B | 9.15 | pKi | 0.7 | nM | Ki | J Med Chem (2007) 50: 4976-4985 [PMID:17850055] |
| ChEMBL | Binding affinity at cloned human Vasopressin V1a receptor stably expressed in CHO cells, using [3H]AVP as radioligand | B | 9.28 | pKi | 0.53 | nM | Ki | J Med Chem (2002) 45: 2589-2598 [PMID:12036368] |
| ChEMBL | Displacement of [125I]OH-Phpa-LVA from human V1A receptor expressed in CHO cells after 4 hrs by gamma counter analysis | B | 9.28 | pKi | 0.53 | nM | Ki | J Med Chem (2018) 61: 10173-10184 [PMID:30395477] |
| ChEMBL | Inhibition of human vasopressin V1a receptor expressed in COS7 cells by HTRF-FRET assay using 384-well plate membranes | B | 9.28 | pKi | 0.52 | nM | Ki | J Med Chem (2007) 50: 4976-4985 [PMID:17850055] |
| GtoPdb | - | - | 9.3 | pKi | - | - | - |
J Biol Chem (1994) 269: 3304-10 [PMID:8106369]; Br J Pharmacol (1998) 125: 1463-70 [PMID:9884074]; Eur J Biochem (2000) 267: 4253-63 [PMID:10866830]; Br J Obstet Gynaecol (1999) 106: 1047-53 [PMID:10519430]; Br J Pharmacol (2005) 146: 744-751 [PMID:16158071] |
| ChEMBL | Inhibition of human vasopressin V1a receptor expressed in COS7 cells by HTRF-FRET assay using 96-well plate membranes | B | 9.72 | pKi | 0.19 | nM | Ki | J Med Chem (2007) 50: 4976-4985 [PMID:17850055] |
| ChEMBL | Antagonist activity at human V1A receptor expressed in CHO cells assessed as inhibition of AVP-induced intracellular calcium release after 30 seconds by FLIPR assay | F | 7.89 | pIC50 | 13 | nM | IC50 | Bioorg Med Chem Lett (2011) 21: 5684-5687 [PMID:21885275] |
| V1A receptor/Vasopressin V1a receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2868] [GtoPdb: 366] [UniProtKB: P30560] | ||||||||
| ChEMBL | Binding affinity at Vasopressin V1a receptor, performed using [3H]AVP on rat liver | B | 8.84 | pKi | 1.43 | nM | Ki | J Med Chem (2002) 45: 2589-2598 [PMID:12036368] |
| V2 receptor/Vasopressin V2 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1790] [GtoPdb: 368] [UniProtKB: P30518] | ||||||||
| ChEMBL | Binding affinity at cloned human Vasopressin V2 receptor stably expressed in CHO cells, using [3H]AVP as radioligand | B | 6.75 | pKi | 178 | nM | Ki | J Med Chem (2002) 45: 2589-2598 [PMID:12036368] |
| GtoPdb | - | - | 6.9 | pKi | - | - | - |
Br J Pharmacol (1998) 125: 1463-70 [PMID:9884074]; Endocrinology (1997) 138: 4109-22 [PMID:9322919]; Eur J Biochem (2000) 267: 4253-63 [PMID:10866830]; Br J Pharmacol (2001) 133: 746-54 [PMID:11429400]; Kidney Int (2000) 58: 1613-22 [PMID:11012895] |
| V2 receptor/Vasopressin V2 receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3766] [GtoPdb: 368] [UniProtKB: Q00788] | ||||||||
| ChEMBL | Binding affinity at Vasopressin V2 receptor, performed using [3H]AVP on rat kidney | B | 6.55 | pKi | 285 | nM | Ki | J Med Chem (2002) 45: 2589-2598 [PMID:12036368] |
| V1B receptor in Human [GtoPdb: 367] [UniProtKB: P47901] | ||||||||
| GtoPdb | - | - | 7.3 | pKi | - | - | - |
Br J Pharmacol (1998) 125: 1463-70 [PMID:9884074]; Endocrinology (1997) 138: 4109-22 [PMID:9322919]; Br J Pharmacol (2001) 133: 746-54 [PMID:11429400]; Br J Pharmacol (2005) 146: 744-751 [PMID:16158071] |
| OT receptor in Human [GtoPdb: 369] [UniProtKB: P30559] | ||||||||
| GtoPdb | - | - | 7 | pKi | - | - | - |
Br J Obstet Gynaecol (1999) 106: 1047-53 [PMID:10519430]; Br J Pharmacol (2005) 146: 744-751 [PMID:16158071] |
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]
