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BDBM50462613 CHEMBL4246864

SMILES: CCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)B(O)O

InChI Key: InChIKey=HCAYFQBLIJQFHP-IRXDYDNUSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50462613   
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
Proteasome subunit beta type-1/beta type-5


(Homo sapiens (Human))
BDBM50462613
PNG
(CHEMBL4246864)
Show SMILES CCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)B(O)O |r|
Show InChI InChI=1S/C19H31BN2O4/c1-4-5-11-18(23)21-16(13-15-9-7-6-8-10-15)19(24)22-17(20(25)26)12-14(2)3/h6-10,14,16-17,25-26H,4-5,11-13H2,1-3H3,(H,21,23)(H,22,24)/t16-,17-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.5n/an/an/an/an/an/a



Nanjing Forestry University

Curated by ChEMBL


Assay Description
Inhibition of chymotrypsin-like activity of human 20S proteasome using Suc-Leu-Leu-Val-Tyr-AMC as substrate incubated for 10 mins followed by substra...


Bioorg Med Chem 26: 3975-3981 (2018)


Article DOI: 10.1016/j.bmc.2018.06.020
BindingDB Entry DOI: 10.7270/Q2Q81GQG
More data for this
Ligand-Target Pair