BindingDB logo
myBDB logout

null

SMILES: COc1cc(O)ccc1-c1nnc(o1)-c1ccc(cc1)-c1nnc(s1)-c1ccccc1Cl

InChI Key: InChIKey=TZTINXDOZVNJNJ-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 1 hit for monomerid = 50510747   
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
Beta-glucuronidase


(Homo sapiens (Human))		BDBM50510747
PNG
(CHEMBL4453038)
Show SMILES COc1cc(O)ccc1-c1nnc(o1)-c1ccc(cc1)-c1nnc(s1)-c1ccccc1Cl
Show InChI InChI=1S/C23H15ClN4O3S/c1-30-19-12-15(29)10-11-17(19)21-26-25-20(31-21)13-6-8-14(9-7-13)22-27-28-23(32-22)16-4-2-3-5-18(16)24/h2-12,29H,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.14E+3n/an/an/an/an/an/a



Imam Abdulrahman Bin Faisal University

Curated by ChEMBL


Assay Description
Inhibition of human beta-glucuronidase pre-incubated for 30 mins before p-nitrophenyl-beta-D-glucuronide substrate addition by spectrophotometry

Bioorg Med Chem 27: 3145-3155 (2019)


Article DOI: 10.1016/j.bmc.2019.05.049
More data for this
Ligand-Target Pair