rimegepant [Ligand Id: 10704] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL2178422 (Bhv-3000, BMS-927711, Rimegepant)
  • calcitonin receptor-like receptor/Calcitonin gene-related peptide type 1 receptor in Human [ChEMBL: CHEMBL3798] [GtoPdb: 47] [UniProtKB: Q16602]
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  • AMY1 receptor in Human [GtoPdb: 44]
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  • CGRP receptor in Human [GtoPdb: 48]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
calcitonin receptor-like receptor/Calcitonin gene-related peptide type 1 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3798] [GtoPdb: 47] [UniProtKB: Q16602]
ChEMBL Displacement of [125I]-CGRP from CGRP receptor in human SK-N-MC cells after 2 hrs by gamma scintillation counter analysis B 10.57 pKi 0.03 nM Ki J Med Chem (2012) 55: 10644-10651 [PMID:23153230]
ChEMBL Antagonist activity at CGRP receptor in human SK-N-MC cells assessed as inhibition of CGRP-stimulated cAMP production preincubated for 15 mins prior to CGRP challenge measured after 30 mins by HTRF assay F 9.85 pEC50 0.14 nM EC50 J Med Chem (2012) 55: 10644-10651 [PMID:23153230]
AMY1 receptor in Human [GtoPdb: 44]
CGRP receptor in Human [GtoPdb: 48]

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]