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BDBM50119290 CHEMBL3613826

SMILES: COC(=O)[C@@H](NC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCCNC(=O)\C=C\[C@H](Cc2ccccc2)NC1=O)C(C)C

InChI Key: InChIKey=XMRIGVZOBXARSW-ZRZXSQDLSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50119290   
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
20S proteasome chymotrypsin-like


(Homo sapiens (Human))
BDBM50119290
PNG
(CHEMBL3613826)
Show SMILES COC(=O)[C@@H](NC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCCNC(=O)\C=C\[C@H](Cc2ccccc2)NC1=O)C(C)C
Show InChI InChI=1S/C33H43N5O6/c1-22(2)29(32(42)44-3)38-33(43)37-27(21-24-14-8-5-9-15-24)31(41)36-26-16-10-11-19-34-28(39)18-17-25(35-30(26)40)20-23-12-6-4-7-13-23/h4-9,12-15,17-18,22,25-27,29H,10-11,16,19-21H2,1-3H3,(H,34,39)(H,35,40)(H,36,41)(H2,37,38,43)/b18-17+/t25-,26+,27+,29+/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
447n/an/an/an/an/an/an/an/a



Brown University

Curated by ChEMBL


Assay Description
Inhibition of human 20S proteasome beta5 subunit using Suc-LLVY-AMC as substrate by fluorescence assay


Bioorg Med Chem 23: 6218-22 (2015)


Article DOI: 10.1016/j.bmc.2015.07.041
BindingDB Entry DOI: 10.7270/Q25B0499
More data for this
Ligand-Target Pair