delavirdine [Ligand Id: 12674] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL593 (Delavirdina, Delavirdine, U-90152)
  • ABCG2/ATP-binding cassette sub-family G member 2 in Human [ChEMBL: CHEMBL5393] [GtoPdb: 792] [UniProtKB: Q9UNQ0]
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  • Beta-lactamase AmpC in Escherichia coli [ChEMBL: CHEMBL2026] [UniProtKB: P00811]
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  • Human immunodeficiency virus type 1 integrase in Human immunodeficiency virus 1 [ChEMBL: CHEMBL3471] [UniProtKB: Q7ZJM1]
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  • Human immunodeficiency virus type 1 protease in Human immunodeficiency virus 1 [ChEMBL: CHEMBL243] [UniProtKB: Q72874]
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  • Human immunodeficiency virus type 1 reverse transcriptase in Human immunodeficiency virus 1 [ChEMBL: CHEMBL247] [UniProtKB: Q72547]
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  • Malate dehydrogenase cytoplasmic in Human [ChEMBL: CHEMBL3560] [UniProtKB: P40925]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
ABCG2/ATP-binding cassette sub-family G member 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5393] [GtoPdb: 792] [UniProtKB: Q9UNQ0]
ChEMBL Inhibition of human ABCG2 expressed in dog MDCK-II-BCRP cells mediated pheophorbide A efflux preincubated with PhA followed by compound addition and measured after 60 mins by flow cytometry B 4.73 pIC50 18700 nM IC50 Eur J Med Chem (2022) 237: 114346-114346 [PMID:35483322]
Beta-lactamase AmpC in Escherichia coli (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2026] [UniProtKB: P00811]
ChEMBL Compound was tested for the inhibition of beta-lactamase B 4.05 pIC50 90000 nM IC50 J Med Chem (2003) 46: 4477-4486 [PMID:14521410]
Human immunodeficiency virus type 1 integrase in Human immunodeficiency virus 1 (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3471] [UniProtKB: Q7ZJM1]
ChEMBL Inhibition of HIV1 integrase B 4 pIC50 >100000 nM IC50 Bioorg Med Chem (2016) 24: 5007-5016 [PMID:27658796]
Human immunodeficiency virus type 1 protease in Human immunodeficiency virus 1 (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL243] [UniProtKB: Q72874]
ChEMBL Inhibition of HIV-1 protease B 8.89 pIC50 1.3 nM IC50 RSC Med Chem (2024) 15: 788-808 [PMID:38516587]
Human immunodeficiency virus type 1 reverse transcriptase in Human immunodeficiency virus 1 (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL247] [UniProtKB: Q72547]
ChEMBL Inhibitory activity against P236L mutant HIV-1 reverse transcriptase B 4.74 pIC50 18000 nM IC50 J Med Chem (1998) 41: 1357-1360 [PMID:9554867]
ChEMBL Inhibition of Reverse transcriptase (P236L) using poly(rA)600:oligo(dT)10 as template primer. B 4.74 pIC50 18000 nM IC50 J Med Chem (1999) 42: 4140-4149 [PMID:10514284]
ChEMBL Inhibition of Reverse transcriptase (Y181C) using poly(rA)600:oligo(dT)10 as template primer. B 5.08 pIC50 8320 nM IC50 J Med Chem (1999) 42: 4140-4149 [PMID:10514284]
ChEMBL Inhibition of wild type recombinant HIV1 reverse transcriptase Y181C mutant using poly(rA)-oligo(dT) as template/primer B 5.08 pIC50 8300 nM IC50 J Med Chem (2019) 62: 4851-4883 [PMID:30516990]
ChEMBL Inhibitory activity against Y181C mutant HIV-1 reverse transcriptase B 5.08 pIC50 8300 nM IC50 J Med Chem (1998) 41: 1357-1360 [PMID:9554867]
ChEMBL Inhibitory activity against HIV-1 reverse transcriptase (P236L) B 5.18 pIC50 6660 nM IC50 J Med Chem (1998) 41: 3793-3803 [PMID:9748354]
ChEMBL Inhibition of recombinant reverse transcriptase (RT) in cell-free Quan-T-RT assay system B 5.82 pIC50 1500 nM IC50 Bioorg Med Chem Lett (1999) 9: 3411-3416 [PMID:10617082]
ChEMBL Inhibitory activity against recombinant HIV-1 reverse transcriptase (rRT) B 5.82 pIC50 1500 nM IC50 Bioorg Med Chem Lett (1999) 9: 2721-2726 [PMID:10509923]
ChEMBL Inhibition of purified recombinant HIV-1 reverse transcriptase B 5.82 pIC50 1500 nM IC50 Bioorg Med Chem Lett (1999) 9: 1593-1598 [PMID:10386942]
ChEMBL Compound was evaluated for its inhibitory activity against recombinant HIV-1 Reverse transcriptase using cell free RT inhibition assay B 5.82 pIC50 1500 nM IC50 Bioorg Med Chem Lett (2000) 10: 2071-2074 [PMID:10999473]
ChEMBL Inhibition of HIV1 wild type reverse transcriptase using poly rC.dG and [3H]dGTP as substrate B 5.92 pIC50 1200 nM IC50 Medchemcomm (2013) 4: 741-748
ChEMBL Dose required to inhibit the HIV-1 Reverse transcriptase activity by 50% B 5.96 pIC50 1100 nM IC50 J Med Chem (2002) 45: 1567-1576 [PMID:11931611]
ChEMBL In vitro for inhibition of HIV-1 reverse transcriptase. B 5.96 pIC50 1100 nM IC50 J Med Chem (1996) 39: 5267-5275 [PMID:8978855]
ChEMBL In vitro inhibition of HIV-1 reverse transcriptase B 5.96 pIC50 1100 nM IC50 J Med Chem (1993) 36: 1505-1508 [PMID:7684450]
ChEMBL Inhibition of HIV-1 reverse transcriptase. B 6.37 pIC50 422 nM IC50 J Med Chem (2000) 43: 2019-2030 [PMID:10821714]
ChEMBL Inhibition of wild type recombinant HIV1 reverse transcriptase using poly(rA)-oligo(dT) as template/primer B 6.59 pIC50 260 nM IC50 J Med Chem (2019) 62: 4851-4883 [PMID:30516990]
ChEMBL Inhibition of Reverse transcriptase (Wild Type) with poly(rA)600:oligo(dT)10 template primer B 6.59 pIC50 260 nM IC50 J Med Chem (1999) 42: 4140-4149 [PMID:10514284]
ChEMBL Inhibitory activity against wild type HIV-1 reverse transcriptase (WT-RT) B 6.59 pIC50 260 nM IC50 J Med Chem (1998) 41: 1357-1360 [PMID:9554867]
ChEMBL Inhibitory activity against HIV-1 reverse transcriptase (wild type) B 6.77 pIC50 170 nM IC50 J Med Chem (1998) 41: 3793-3803 [PMID:9748354]
ChEMBL HIV-1 reverse transcriptase inhibitory activity against Asn103 mutant using (poly)rC600*(oligo)dGT as template primer. B 7.25 pIC50 56 nM IC50 J Med Chem (1999) 42: 4150-4160 [PMID:10514285]
ChEMBL Inhibition of recombinant HIV1 non-nucleoside reverse transcriptase B 7.44 pIC50 36 nM IC50 Bioorg Med Chem (2016) 24: 5007-5016 [PMID:27658796]
ChEMBL Inhibitory concentration against wild-type reverse transcriptase of HIV-1 B 7.68 pIC50 21 nM IC50 J Med Chem (2004) 47: 1175-1182 [PMID:14971897]
ChEMBL HIV-1 reverse transcriptase inhibitory activity against Cys181 mutant using (poly)rC600*(oligo)dGT as template primer. B 8.05 pIC50 9 nM IC50 J Med Chem (1999) 42: 4150-4160 [PMID:10514285]
ChEMBL HIV-1 reverse transcriptase inhibitory activity against Ile 100 mutant using (poly)rC600*(oligo)dGT as template primer. B 8.05 pIC50 9 nM IC50 J Med Chem (1999) 42: 4150-4160 [PMID:10514285]
ChEMBL HIV-1 reverse transcriptase inhibitory activity against Wild Type Reverse transcriptase using (poly)rC600*(oligo)dGT as template primer. B 8.1 pIC50 8 nM IC50 J Med Chem (1999) 42: 4150-4160 [PMID:10514285]
ChEMBL Inhibition of HIV1 RES056 reverse transcriptase K103N/Y181C double mutant infected in human MT4 cells assessed as protection against virus-induced cytopathic effect measured at 5 days post infection by MTT assay B 4.64 pEC50 >23000 nM EC50 Bioorg Med Chem (2017) 25: 2491-2497 [PMID:28314514]
ChEMBL Inhibition of HIV RT K103N/Y181C mutant by cell based assay B 5 pEC50 >10000 nM EC50 Eur J Med Chem (2013) 65: 134-143 [PMID:23707918]
ChEMBL Inhibition of HIV-1 reverse transcriptase E138K mutant infected in human MT4 cells assessed as protection against virus-induced cytopathic effect measured at 5 days post infection by MTT assay B 7.12 pEC50 76 nM EC50 Bioorg Med Chem (2017) 25: 2491-2497 [PMID:28314514]
Malate dehydrogenase cytoplasmic in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3560] [UniProtKB: P40925]
ChEMBL Inhibition of malate dehydrogenase (MDH) B 4.07 pIC50 85000 nM IC50 J Med Chem (2003) 46: 4477-4486 [PMID:14521410]
Plasmodium falciparum (target type: ORGANISM) [ChEMBL: CHEMBL364]
ChEMBL Antiplasmodial activity against chloroquine-resistant Plasmodium falciparum K1 infected in human O positive erythrocyte assessed as reduction in parasitemia after 72 hrs F 4.19 pIC50 64000 nM IC50 Bioorg Med Chem (2014) 22: 5241-5248 [PMID:25199582]
Plasmodium yoelii yoelii (target type: ORGANISM) [ChEMBL: CHEMBL612328]
ChEMBL Antimicrobial activity against Plasmodium yoelii 265 liver infected in mammalian hepatocytes after 48 hrs F 9.07 pIC50 0.85 nM IC50 Antimicrob Agents Chemother (2008) 52: 1215-1220 [PMID:18212104]
ChEMBL Antimalarial activity against liver stages of Plasmodium yoelii yoelii F 9.07 pIC50 0.85 nM IC50 J Med Chem (2012) 55: 995-1012 [PMID:22122518]

ChEMBL data shown on this page come from version 34:

Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
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]