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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Ribonucleoside-diphosphate reductase subunit alpha' and Ligand = 'BDBM50431417'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ribonucleoside-diphosphate reductase subunit alpha


(Mycobacterium tuberculosis)
BDBM50431417
PNG
(CHEMBL2348059)
Show SMILES OC(=O)CN1Cc2cccc(NC(=O)OCC3c4ccccc4-c4ccccc34)c2N[C@@H](Cc2c[nH]c3ccccc23)C1=O |r|
Show InChI InChI=1S/C35H30N4O5/c40-32(41)19-39-18-21-8-7-15-30(33(21)37-31(34(39)42)16-22-17-36-29-14-6-5-9-23(22)29)38-35(43)44-20-28-26-12-3-1-10-24(26)25-11-2-4-13-27(25)28/h1-15,17,28,31,36-37H,16,18-20H2,(H,38,43)(H,40,41)/t31-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 8.10E+3n/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Displacement of Dansyl-Gly-Ser-Gly-Glu-Asp-Asp-Asp-Trp-Asp-Phe from C-terminal R1 subunit of Mycobacterium tuberculosis ribonucleotide reductase by f...


Bioorg Med Chem 21: 1992-2000 (2013)


Article DOI: 10.1016/j.bmc.2013.01.020
BindingDB Entry DOI: 10.7270/Q2T43VG6
More data for this
Ligand-Target Pair