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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cytochrome b' and Ligand = 'BDBM192103'   
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
Cytochrome b


(Candida albicans (Yeast))
BDBM192103
PNG
(Inz-94)
Show SMILES Fc1ccc(cc1-c1nn(Cc2cnccn2)c2ccccc12)C(F)(F)F
Show InChI InChI=1S/C19H12F4N4/c20-16-6-5-12(19(21,22)23)9-15(16)18-14-3-1-2-4-17(14)27(26-18)11-13-10-24-7-8-25-13/h1-10H,11H2
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 449n/an/an/an/a7.425



Massachusetts Institute of Technology



Assay Description
The cytochrome b enzyme assay was adapted from previous studies (Gutierrez-Cirlos et al., 2004). Briefly, compounds were diluted in a 23 reaction buf...


Cell Chem Biol 23: 978-991 (2016)


Article DOI: 10.1016/j.chembiol.2016.06.016
BindingDB Entry DOI: 10.7270/Q2SX6C1B
More data for this
Ligand-Target Pair
Cytochrome b


(Homo sapiens (Human))
BDBM192103
PNG
(Inz-94)
Show SMILES Fc1ccc(cc1-c1nn(Cc2cnccn2)c2ccccc12)C(F)(F)F
Show InChI InChI=1S/C19H12F4N4/c20-16-6-5-12(19(21,22)23)9-15(16)18-14-3-1-2-4-17(14)27(26-18)11-13-10-24-7-8-25-13/h1-10H,11H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.51E+4n/an/an/an/a7.425



Massachusetts Institute of Technology



Assay Description
The cytochrome b enzyme assay was adapted from previous studies (Gutierrez-Cirlos et al., 2004). Briefly, compounds were diluted in a 23 reaction buf...


Cell Chem Biol 23: 978-991 (2016)


Article DOI: 10.1016/j.chembiol.2016.06.016
BindingDB Entry DOI: 10.7270/Q2SX6C1B
More data for this
Ligand-Target Pair