BindingDB logo
myBDB logout

null

SMILES: CCOC(=O)c1sc(=S)n(CC=C)c1NC(=O)c1ccc(Br)o1

InChI Key: InChIKey=SPDNQZLTBBTUCV-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 34329   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
ATP-dependent molecular chaperone HSP82


(Candida albicans)
BDBM34329
PNG
(3-allyl-4-[(5-bromo-2-furoyl)amino]-2-thioxo-4-thi...)
Show SMILES CCOC(=O)c1sc(=S)n(CC=C)c1NC(=O)c1ccc(Br)o1
Show InChI InChI=1S/C14H13BrN2O4S2/c1-3-7-17-11(10(23-14(17)22)13(19)20-4-2)16-12(18)8-5-6-9(15)21-8/h3,5-6H,1,4,7H2,2H3,(H,16,18)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 4.93E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q26M358G
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM34329
PNG
(3-allyl-4-[(5-bromo-2-furoyl)amino]-2-thioxo-4-thi...)
Show SMILES CCOC(=O)c1sc(=S)n(CC=C)c1NC(=O)c1ccc(Br)o1
Show InChI InChI=1S/C14H13BrN2O4S2/c1-3-7-17-11(10(23-14(17)22)13(19)20-4-2)16-12(18)8-5-6-9(15)21-8/h3,5-6H,1,4,7H2,2H3,(H,16,18)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 827n/an/an/an/a8.023



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
A fluorescence resonance energy transfer assay is developed in 96-well and 384-well microplate formats with robotic manipulation to enable high-throu...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2H70D5W
More data for this
Ligand-Target Pair