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BDBM50284073 CHEMBL4170931

SMILES: Cc1ccc(cc1)C(c1c[nH]c2ccc(cc12)C(=O)N\N=C\c1ccccc1)c1c[nH]c2ccc(cc12)C(=O)N\N=C\c1ccccc1

InChI Key: InChIKey=SGFQSOFPQOAGPC-IOHLRWCLSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50284073   
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 (β-glucuronidase)


(Homo sapiens (Human))
BDBM50284073
PNG
(CHEMBL4170931)
Show SMILES Cc1ccc(cc1)C(c1c[nH]c2ccc(cc12)C(=O)N\N=C\c1ccccc1)c1c[nH]c2ccc(cc12)C(=O)N\N=C\c1ccccc1
Show InChI InChI=1S/C40H32N6O2/c1-26-12-14-29(15-13-26)38(34-24-41-36-18-16-30(20-32(34)36)39(47)45-43-22-27-8-4-2-5-9-27)35-25-42-37-19-17-31(21-33(35)37)40(48)46-44-23-28-10-6-3-7-11-28/h2-25,38,41-42H,1H3,(H,45,47)(H,46,48)/b43-22+,44-23+
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 4.28E+4n/an/an/an/an/an/a



Imam Abdulrahman Bin Faisal University

Curated by ChEMBL


Assay Description
Inhibition of human beta-glucuronidase


Eur J Med Chem 143: 1757-1767 (2018)


Article DOI: 10.1016/j.ejmech.2017.10.071
BindingDB Entry DOI: 10.7270/Q23N25X1
More data for this
Ligand-Target Pair