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ChEMBL ligand: CHEMBL236593 (Mk-0974, MK-0974, MK0974, Telcagepant) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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Calcitonin gene-related peptide 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5293] [UniProtKB: P06881] | ||||||||
ChEMBL | Inhibition of human CGRP receptor expressed in huamn HEK293 cells coexpressing CLR/RAMP1 assessed as inhibition of CGRP-stimulated cAMP production after 1 hr | B | 4 | pKi | >100000 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 6705-6708 [PMID:21982500] |
ChEMBL | Displacement of [125I]adrenomedullin form CGRP receptor in human SK-N-MC cell membrane by competitive binding assay | B | 9.11 | pKi | 0.78 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 6705-6708 [PMID:21982500] |
ChEMBL | Inhibition of human CGRP receptor expressed in huamn HEK293 cells coexpressing CLR/RAMP1 assessed as inhibition of CGRP-stimulated cAMP production after 1 hr | B | 8.66 | pIC50 | 2.2 | nM | IC50 | Bioorg Med Chem Lett (2011) 21: 6705-6708 [PMID:21982500] |
Calcitonin gene-related peptide 1 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5735] [UniProtKB: P01256] | ||||||||
ChEMBL | Inhibition of rat CGRP | B | 5.92 | pKi | 1200 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 6705-6708 [PMID:21982500] |
RAMP1/calcitonin receptor-like receptor/Calcitonin-gene-related peptide receptor, CALCRL/RAMP1 in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL2107838] [GtoPdb: 51, 47] [UniProtKB: O60894, Q16602] | ||||||||
ChEMBL | Inhibition of human CLR/RAMP1 | B | 9.11 | pKi | 0.77 | nM | Ki | J Med Chem (2020) 63: 6600-6623 [PMID:32058712] |
calcitonin receptor-like receptor/Calcitonin gene-related peptide type 1 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3798] [GtoPdb: 47] [UniProtKB: Q16602] | ||||||||
ChEMBL | Antagonist activity against CGRP receptor assessed as inhibition of CGRP-mediated vasorelaxation in human coronary arteries | B | 8.43 | pKd | 3.71 | nM | Kd | J Med Chem (2014) 57: 7838-7858 [PMID:24960305] |
ChEMBL | Reversible saturable binding affinity to human CGRP receptor using [3H]-labeled compound | B | 8.72 | pKd | 1.9 | nM | Kd | J Med Chem (2014) 57: 7838-7858 [PMID:24960305] |
ChEMBL | Displacement of [125I]-CGRP from human recombinant CGRP receptor | B | 9.1 | pKi | 0.8 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 2683-2686 [PMID:21251825] |
ChEMBL | Displacement of [125I]human CGRP from human CLR expressed in HEK293 cells coexpressing human RAMP1 | B | 9.1 | pKi | 0.8 | nM | Ki | Bioorg Med Chem Lett (2009) 19: 4740-4742 [PMID:19577468] |
ChEMBL | Displacement of [125I]human CGRP from human CLR expressed in HEK 293 cells coexpressing human RAMP1 after 3 hrs by scintillation counting | B | 9.1 | pKi | 0.8 | nM | Ki | Bioorg Med Chem Lett (2009) 19: 6368-6372 [PMID:19818613] |
ChEMBL | Displacement of [125I]CGPR from human CL receptor expressed in HEK293 cells | B | 9.11 | pKi | 0.77 | nM | Ki | J Med Chem (2007) 50: 5564-5567 [PMID:17929795] |
ChEMBL | Antagonist activity at human CGRP receptor | B | 9.11 | pKi | 0.77 | nM | Ki | Bioorg Med Chem Lett (2013) 23: 3157-3161 [PMID:23632269] |
ChEMBL | Displacement of [125I]-hCGRP from human CGRP receptor expressed in HEK293 cells | B | 9.11 | pKi | 0.77 | nM | Ki | ACS Med Chem Lett (2013) 4: 863-868 [PMID:24900761] |
ChEMBL | Binding affinity to human CGRP receptor | B | 9.11 | pKi | 0.77 | nM | Ki | J Med Chem (2014) 57: 7838-7858 [PMID:24960305] |
ChEMBL | Antagonist activity against human CGRP receptor in presence of 50% human serum by cell based cAMP accumulation assay | F | 7.96 | pIC50 | 11 | nM | IC50 | J Med Chem (2014) 57: 7838-7858 [PMID:24960305] |
ChEMBL | Antagonist activity at human CL receptor expressed in E10 cells assessed as CGRP-stimulated cAMP production in presence of 50% human serum | F | 7.96 | pIC50 | 11 | nM | IC50 | J Med Chem (2007) 50: 5564-5567 [PMID:17929795] |
ChEMBL | Antagonist activity at human CLR expressed in HEK293 cells coexpressing human RAMP1 assessed as inhibition of human CGRPalpha-induced cAMP production after 30 mins by scintillation proximity assay in presence of 50% human serum | F | 7.96 | pIC50 | 11 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4740-4742 [PMID:19577468] |
ChEMBL | Antagonist activity at human CLR expressed in HEK293 cells coexpressing human RAMP1 assessed as inhibition of human CGRPalpha-induced cAMP production after 5 mins in presence of 50% human serum by scintillation proximity assay | F | 7.96 | pIC50 | 11 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 6368-6372 [PMID:19818613] |
ChEMBL | Antagonist activity at CGRP receptor assessed as inhibition of CGRP-stimulated cAMP production by cell based assay in presence of 50% human serum | F | 7.96 | pIC50 | 11 | nM | IC50 | Bioorg Med Chem Lett (2011) 21: 2683-2686 [PMID:21251825] |
ChEMBL | Antagonist activity at human CLR expressed in HEK293 cells coexpressing human RAMP1 assessed as inhibition of human CGRPalpha-induced cAMP production after 30 mins by scintillation proximity assay | F | 8.62 | pIC50 | 2.4 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4740-4742 [PMID:19577468] |
ChEMBL | Antagonist activity against human CGRP receptor by cell based cAMP accumulation assay | F | 8.66 | pIC50 | 2.2 | nM | IC50 | J Med Chem (2014) 57: 7838-7858 [PMID:24960305] |
ChEMBL | Antagonist activity at human CL receptor expressed in E10 cells assessed as CGRP-stimulated cAMP production | F | 8.66 | pIC50 | 2.2 | nM | IC50 | J Med Chem (2007) 50: 5564-5567 [PMID:17929795] |
ChEMBL | Antagonist activity at CGRP receptor assessed as inhibition of CGRP-stimulated cAMP production by cell based assay | F | 8.7 | pIC50 | 2 | nM | IC50 | Bioorg Med Chem Lett (2011) 21: 2683-2686 [PMID:21251825] |
ChEMBL | Antagonist activity at human CLR expressed in HEK293 cells coexpressing human RAMP1 assessed as inhibition of human CGRPalpha-induced cAMP production after 5 mins by scintillation proximity assay | F | 8.7 | pIC50 | 2 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 6368-6372 [PMID:19818613] |
CGRP receptor in Human [GtoPdb: 48] | ||||||||
GtoPdb | - | - | 9.1 | pKi | - | - | - | J Pharmacol Exp Ther (2008) 324: 416-21 [PMID:18039958] |
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]