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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Protein RecA' and Ligand = 'BDBM40085'   
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
Protein RecA


(Mycobacterium tuberculosis H37Rv)
BDBM40085
PNG
(2-furancarboxylic acid [4-(2,5-dioxo-1-pyrrolidiny...)
Show SMILES Oc1ccc(O)n1-c1ccc(OC(=O)c2ccco2)cc1
Show InChI InChI=1S/C15H11NO5/c17-13-7-8-14(18)16(13)10-3-5-11(6-4-10)21-15(19)12-2-1-9-20-12/h1-9,17-18H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 388n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: GFP-RecA intein, protein splicing, refolding, reducing reagent, GFP fluorescence Assay Overview: M. tuberculosis harbors three inteins, whi...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2DR2SX9
More data for this
Ligand-Target Pair
Protein RecA


(Mycobacterium tuberculosis H37Rv)
BDBM40085
PNG
(2-furancarboxylic acid [4-(2,5-dioxo-1-pyrrolidiny...)
Show SMILES Oc1ccc(O)n1-c1ccc(OC(=O)c2ccco2)cc1
Show InChI InChI=1S/C15H11NO5/c17-13-7-8-14(18)16(13)10-3-5-11(6-4-10)21-15(19)12-2-1-9-20-12/h1-9,17-18H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 606n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: GFP, refolding, reducing reagent, GFP fluorescence Assay Overview: M. tuberculosis harbors three inteins, which interrupt the DnaB, RecA, a...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2FN14NR
More data for this
Ligand-Target Pair