boceprevir [Ligand Id: 7876] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL218394 (Boceprevir, EBP 520, EBP-520, SCH 503034, SCH-503034, Victrelis)
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  • chymotrypsin like elastase 1/Elastase 1 in Human [ChEMBL: CHEMBL3000] [GtoPdb: 2338] [UniProtKB: Q9UNI1]
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  • elastase, neutrophil expressed/Leukocyte elastase in Human [ChEMBL: CHEMBL248] [GtoPdb: 2358] [UniProtKB: P08246]
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  • coagulation factor II, thrombin/Thrombin in Human [ChEMBL: CHEMBL204] [GtoPdb: 2362] [UniProtKB: P00734]
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  • Cathepsin A in Human [GtoPdb: 1581] [UniProtKB: P10619]
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  • CoV 3C-like (main) protease in SARS-CoV [GtoPdb: 3111] [UniProtKB: P0C6U8]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
cathepsin B/Cathepsin B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4072] [GtoPdb: 2343] [UniProtKB: P07858]
ChEMBL Inhibition of human CatB after 60 mins fluorescence assay B 5.21 pIC50 6200 nM IC50 Antimicrob Agents Chemother (2010) 54: 4611-4618 [PMID:20823284]
ChEMBL Inhibition of human Cathepsin B B 5.48 pIC50 >3300 nM IC50 Antimicrob Agents Chemother (2010) 54: 305-311 [PMID:19841155]
cathepsin F/Cathepsin F in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2517] [GtoPdb: 2347] [UniProtKB: Q9UBX1]
ChEMBL Inhibition of human Cathepsin F B 5.96 pIC50 1100 nM IC50 Antimicrob Agents Chemother (2010) 54: 305-311 [PMID:19841155]
cathepsin K/Cathepsin K in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL268] [GtoPdb: 2350] [UniProtKB: P43235]
ChEMBL Inhibition of human Cathepsin K B 7.4 pIC50 40 nM IC50 Antimicrob Agents Chemother (2010) 54: 305-311 [PMID:19841155]
cathepsin L/Cathepsin L in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3837] [GtoPdb: 2351] [UniProtKB: P07711]
ChEMBL Inhibition of human Cathepsin L B 6.12 pIC50 760 nM IC50 Antimicrob Agents Chemother (2010) 54: 305-311 [PMID:19841155]
cathepsin V/Cathepsin L2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3272] [GtoPdb: 2352] [UniProtKB: O60911]
ChEMBL Inhibition of human Cathepsin V B 7.12 pIC50 75 nM IC50 Antimicrob Agents Chemother (2010) 54: 305-311 [PMID:19841155]
cathepsin S/Cathepsin S in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2954] [GtoPdb: 2353] [UniProtKB: P25774]
ChEMBL Inhibition of human cathepsin S B 4 pIC50 >100000 nM IC50 Bioorg Med Chem Lett (2013) 23: 6325-6330 [PMID:24135727]
ChEMBL Inhibition of human Cathepsin S B 6.92 pIC50 120 nM IC50 Antimicrob Agents Chemother (2010) 54: 305-311 [PMID:19841155]
chymase 1/Chymase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4068] [GtoPdb: 2340] [UniProtKB: P23946]
ChEMBL Inhibition of human Chymase B 7.49 pIC50 32 nM IC50 Antimicrob Agents Chemother (2010) 54: 305-311 [PMID:19841155]
chymotrypsin like elastase 1/Elastase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3000] [GtoPdb: 2338] [UniProtKB: Q9UNI1]
ChEMBL Inhibition of human Pancreatic elastase 1 B 5 pIC50 >10000 nM IC50 Antimicrob Agents Chemother (2010) 54: 305-311 [PMID:19841155]
Hepatitis C virus serine protease, NS3/NS4A in Hepatitis C virus (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL2095231] [UniProtKB: A3EZI9, D2K2A8]
ChEMBL Inhibition of HCV genotype 1a NS3/4A protease using Ac-DED(Edans)EEAbu-psi[COO]ASK(Dabcyl)-NH2 as substrate by FRET assay B 7.85 pKi 14 nM Ki Bioorg Med Chem (2014) 22: 6595-6615 [PMID:25456385]
elastase, neutrophil expressed/Leukocyte elastase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL248] [GtoPdb: 2358] [UniProtKB: P08246]
ChEMBL Inhibition of human neutrophil elastase B 4 pIC50 >=100000 nM IC50 Bioorg Med Chem Lett (2013) 23: 6325-6330 [PMID:24135727]
ChEMBL Inhibition of human leukocyte elastase after 60 mins fluorescence assay B 4.77 pIC50 17000 nM IC50 Antimicrob Agents Chemother (2010) 54: 4611-4618 [PMID:20823284]
ChEMBL Inhibition of human Neutrophil elastase 2 B 5 pIC50 >10000 nM IC50 Antimicrob Agents Chemother (2010) 54: 305-311 [PMID:19841155]
NS3 in Hepatitis C virus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1293269] [UniProtKB: A3EZJ3]
ChEMBL Binding affinity at HCV NS3 protease B 7.85 pKi 14 nM Ki J Med Chem (2006) 49: 6074-6086 [PMID:17004721]
plasminogen/Plasminogen in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1801] [GtoPdb: 2394] [UniProtKB: P00747]
ChEMBL Inhibition of human plasmin B 4 pIC50 >100000 nM IC50 Bioorg Med Chem Lett (2013) 23: 6325-6330 [PMID:24135727]
coagulation factor II, thrombin/Thrombin in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL204] [GtoPdb: 2362] [UniProtKB: P00734]
ChEMBL Inhibition of human thrombin B 6 pIC50 <1000 nM IC50 Bioorg Med Chem Lett (2013) 23: 6325-6330 [PMID:24135727]
Cathepsin A in Human [GtoPdb: 1581] [UniProtKB: P10619]
GtoPdb - - 6 pIC50 1000 nM IC50 WO2013072327. Use of boceprevir and related compounds in atherosclerosis, heart failure, renal diseases, liver diseases or inflammatory diseases. (2013)
CoV 3C-like (main) protease in SARS-CoV [GtoPdb: 3111] [UniProtKB: P0C6U8]
GtoPdb - - 6.02 pIC50 949 nM IC50 Nature Research (2020) : ;
PLoS One (2021) 16: e0245962 [PMID:33524017]

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]