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BDBM50260528 CHEMBL4063725

SMILES: [O-][N+](=O)c1ccc(Nc2ccc3[nH]c(=O)[nH]c3c2)c(Cl)c1

InChI Key: InChIKey=LBXJVISQYZQJLT-UHFFFAOYSA-N

Data: 1 Kd

PDB links: 1 PDB ID matches this monomer.

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 1 hit for monomerid = 50260528   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
BCoR-BCL6


(Homo sapiens)
BDBM50260528
PNG
(CHEMBL4063725)
Show SMILES [O-][N+](=O)c1ccc(Nc2ccc3[nH]c(=O)[nH]c3c2)c(Cl)c1
Show InChI InChI=1S/C13H9ClN4O3/c14-9-6-8(18(20)21)2-4-10(9)15-7-1-3-11-12(5-7)17-13(19)16-11/h1-6,15H,(H2,16,17,19)
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PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/a 5.00E+3n/an/an/an/an/a



Takeda Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Binding affinity to wild-type avi-tagged BCL6 BTB domain (unknown origin) by SPR analysis


Bioorg Med Chem 25: 4876-4886 (2017)


Article DOI: 10.1016/j.bmc.2017.07.037
BindingDB Entry DOI: 10.7270/Q2G44SR7
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)