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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'DNA dC->dU-editing enzyme APOBEC-3G' and Ligand = 'BDBM80356'   
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
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80356
PNG
(MLS000036597 | N-[3-[5-[2-(furan-2-ylmethylamino)-...)
Show SMILES CCC(=O)Nc1cccc(c1)-c1nnc(SCC(=O)NCc2ccco2)n1C
Show InChI InChI=1S/C19H21N5O3S/c1-3-16(25)21-14-7-4-6-13(10-14)18-22-23-19(24(18)2)28-12-17(26)20-11-15-8-5-9-27-15/h4-10H,3,11-12H2,1-2H3,(H,20,26)(H,21,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 695n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2TX3CZM
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80356
PNG
(MLS000036597 | N-[3-[5-[2-(furan-2-ylmethylamino)-...)
Show SMILES CCC(=O)Nc1cccc(c1)-c1nnc(SCC(=O)NCc2ccco2)n1C
Show InChI InChI=1S/C19H21N5O3S/c1-3-16(25)21-14-7-4-6-13(10-14)18-22-23-19(24(18)2)28-12-17(26)20-11-15-8-5-9-27-15/h4-10H,3,11-12H2,1-2H3,(H,20,26)(H,21,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.50E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q25H7DV5
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80356
PNG
(MLS000036597 | N-[3-[5-[2-(furan-2-ylmethylamino)-...)
Show SMILES CCC(=O)Nc1cccc(c1)-c1nnc(SCC(=O)NCc2ccco2)n1C
Show InChI InChI=1S/C19H21N5O3S/c1-3-16(25)21-14-7-4-6-13(10-14)18-22-23-19(24(18)2)28-12-17(26)20-11-15-8-5-9-27-15/h4-10H,3,11-12H2,1-2H3,(H,20,26)(H,21,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.36E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2862DX0
More data for this
Ligand-Target Pair