BindingDB logo
myBDB logout

null

SMILES: CCc1nnc(NC(=O)CSc2nnc(o2)-c2ccc(NS(=O)(=O)c3ccccc3)cc2)s1

InChI Key: InChIKey=VUCKRLOLRYXLTC-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 = 53807   
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
M17 leucyl aminopeptidase


(Plasmodium falciparum 3D7)
BDBM53807
PNG
(2-[5-(4-Benzenesulfonylamino-phenyl)-[1,3,4]oxadia...)
Show SMILES CCc1nnc(NC(=O)CSc2nnc(o2)-c2ccc(NS(=O)(=O)c3ccccc3)cc2)s1
Show InChI InChI=1S/C20H18N6O4S3/c1-2-17-22-24-19(32-17)21-16(27)12-31-20-25-23-18(30-20)13-8-10-14(11-9-13)26-33(28,29)15-6-4-3-5-7-15/h3-11,26H,2,12H2,1H3,(H,21,24,27)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.00E+3n/an/an/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q27W69N8
More data for this
Ligand-Target Pair
M1 family aminopeptidase


(Plasmodium falciparum (isolate FcB1 / Columbia))
BDBM53807
PNG
(2-[5-(4-Benzenesulfonylamino-phenyl)-[1,3,4]oxadia...)
Show SMILES CCc1nnc(NC(=O)CSc2nnc(o2)-c2ccc(NS(=O)(=O)c3ccccc3)cc2)s1
Show InChI InChI=1S/C20H18N6O4S3/c1-2-17-22-24-19(32-17)21-16(27)12-31-20-25-23-18(30-20)13-8-10-14(11-9-13)26-33(28,29)15-6-4-3-5-7-15/h3-11,26H,2,12H2,1H3,(H,21,24,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.98E+4n/an/an/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27H1H0J
More data for this
Ligand-Target Pair