vancomycin [Ligand Id: 10932] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL262777 (Vancoled, Vancomicina, Vancomycin, Vancomycine, Vancor)
  • α2A-adrenoceptor/Alpha-2a adrenergic receptor in Human [ChEMBL: CHEMBL1867] [GtoPdb: 25] [UniProtKB: P08913]
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  • D-alanyl-D-alanine dipeptidase in Enterococcus faecium [ChEMBL: CHEMBL1681622] [UniProtKB: Q06241]
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  • Norepinephrine transporter in Rat [ChEMBL: CHEMBL304] [UniProtKB: Q9WTR4]
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  • UDP-N-acetylglucosamine--N-acetylmuramyl-(pentapeptide) pyrophosphoryl-undecaprenol N-acetylglucosamine transferase in Escherichia coli [ChEMBL: CHEMBL3596078] [UniProtKB: P17443]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
α2A-adrenoceptor/Alpha-2a adrenergic receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1867] [GtoPdb: 25] [UniProtKB: P08913]
ChEMBL Binding affinity for human alpha-2 adrenergic receptor expressed in CHO cell B 7.3 pKi 50.12 nM Ki J Med Chem (2001) 44: 787-805 [PMID:11262089]
D-alanyl-D-alanine dipeptidase in Enterococcus faecium (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1681622] [UniProtKB: Q06241]
ChEMBL Inhibition of D,D-dipeptidase activity Van X in Enterococcus faecium ATCC 51559 using D-alanyl-(R)-phenylthioglycine substrate B 4.21 pKi 62000 nM Ki Antimicrob Agents Chemother (2010) 54: 2814-2818 [PMID:20404117]
GroEL/GroES in Escherichia coli (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106139] [UniProtKB: Q548M1, Q7BGE6]
ChEMBL Inhibition of Escherichia coli GroEL expressed in Escherichia coli DH5alpha/Escherichia coli GroES expressed in Escherichia coli BL21 (DE3) assessed as reduction in GroEL/GroES-mediated denatured MDH refolding after 20 to 40 mins by spectrometric analysis B 4 pIC50 >100000 nM IC50 J Med Chem (2018) 61: 10651-10664 [PMID:30392371]
ChEMBL Inhibition of Escherichia coli GroEL expressed in Escherichia coli DH5alpha/Escherichia coli GroES expressed in Escherichia coli BL21 (DE3) assessed as reduction in GroEL/GroES-mediated denatured rhodanese refolding after 45 mins by spectrometric analysis B 4 pIC50 >100000 nM IC50 J Med Chem (2018) 61: 10651-10664 [PMID:30392371]
HSP60/HSP10 in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106131] [UniProtKB: P10809, P61604]
ChEMBL Inhibition of human N-terminal octa-His-tagged HSP60 expressed in Escherichia coli Rosetta(DE3) pLysS/human HSP10 expressed in Escherichia coli Rosetta(DE3) assessed as reduction in HSP60/HSP10-mediated denatured MDH refolding after 40 to 60 mins by spectrometric analysis B 4 pIC50 >100000 nM IC50 J Med Chem (2018) 61: 10651-10664 [PMID:30392371]
Norepinephrine transporter in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL304] [UniProtKB: Q9WTR4]
ChEMBL In vitro binding affinity was determined against NA (noradrenaline) reuptake site of rat in presence of [3H]nisoxetine radioligand F 7.8 pKi 15.85 nM Ki J Med Chem (2001) 44: 787-805 [PMID:11262089]
SERT/Serotonin transporter in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL313] [GtoPdb: 928] [UniProtKB: P31652]
ChEMBL In vitro binding affinity was determined against serotonin reuptake site of rat in presence of [3H]paroxetine radioligand F 7.3 pKi 50.12 nM Ki J Med Chem (2001) 44: 787-805 [PMID:11262089]
Thiosulfate sulfurtransferase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4295835] [UniProtKB: Q16762]
ChEMBL Inhibition of refolded rhodanese (unknown origin) preincubated with Escherichia coli GroEL/GroES for 60 mins in absence of compound followed by compound addition by spectrometric analysis B 4 pIC50 >100000 nM IC50 J Med Chem (2018) 61: 10651-10664 [PMID:30392371]
UDP-N-acetylglucosamine--N-acetylmuramyl-(pentapeptide) pyrophosphoryl-undecaprenol N-acetylglucosamine transferase in Escherichia coli (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3596078] [UniProtKB: P17443]
ChEMBL Inhibition of Escherichia coli MurG B 5 pIC50 10000 nM IC50 Medchemcomm (2014) 5: 1106-1125

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]