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BDBM50046148 CHEMBL3310973

SMILES: Brc1ccc(NNS(=O)(=O)c2ccccc2)cc1

InChI Key: InChIKey=RKBFGGAELMSVGA-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 50046148   
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
Indoleamine 2,3-dioxygenase


(Homo sapiens (Human))
BDBM50046148
PNG
(CHEMBL3310973)
Show SMILES Brc1ccc(NNS(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C12H11BrN2O2S/c13-10-6-8-11(9-7-10)14-15-18(16,17)12-4-2-1-3-5-12/h1-9,14-15H
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 172n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IDO expressed in Escherichia coli using N-formylkynurenine as substrate incubated for 1 hr prior to NaOH addition mea...


Bioorg Med Chem Lett 24: 3403-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.084
BindingDB Entry DOI: 10.7270/Q23R0VH6
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase


(Homo sapiens (Human))
BDBM50046148
PNG
(CHEMBL3310973)
Show SMILES Brc1ccc(NNS(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C12H11BrN2O2S/c13-10-6-8-11(9-7-10)14-15-18(16,17)12-4-2-1-3-5-12/h1-9,14-15H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 128n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibition of IDO in human HeLa cells after 24 hrs by spectrophotometry


Bioorg Med Chem Lett 24: 3403-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.084
BindingDB Entry DOI: 10.7270/Q23R0VH6
More data for this
Ligand-Target Pair