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BDBM50444885 CHEMBL3099637

SMILES: CC(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1

InChI Key: InChIKey=UUODGPHLMZLCLQ-UHFFFAOYSA-N

Data: 3 IC50

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 3 hits for monomerid = 50444885   
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 Macropain subunit


(Homo sapiens (Human))
BDBM50444885
PNG
(CHEMBL3099637)
Show SMILES CC(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1
Show InChI InChI=1S/C30H44N2O2/c1-26(27-10-14-29(15-11-27)33-24-22-31-18-6-2-3-7-19-31)28-12-16-30(17-13-28)34-25-23-32-20-8-4-5-9-21-32/h10-17,26H,2-9,18-25H2,1H3
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Bio-Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of trypsin-like activity of human 20S proteasome beta 2 subunit assessed as hydrolysis of Boc-LRR-AMC fluorogenic substrate measured for 1...


Eur J Med Chem 71: 290-305 (2014)


Article DOI: 10.1016/j.ejmech.2013.11.009
BindingDB Entry DOI: 10.7270/Q2222W81
More data for this
Ligand-Target Pair
Proteasome component C5


(Homo sapiens (Human))
BDBM50444885
PNG
(CHEMBL3099637)
Show SMILES CC(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1
Show InChI InChI=1S/C30H44N2O2/c1-26(27-10-14-29(15-11-27)33-24-22-31-18-6-2-3-7-19-31)28-12-16-30(17-13-28)34-25-23-32-20-8-4-5-9-21-32/h10-17,26H,2-9,18-25H2,1H3
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Article
PubMed
n/an/a 790n/an/an/an/an/an/a



Institute of Bio-Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of PGPH-like activity of human 20S proteasome beta 1 subunit assessed as hydrolysis of Z-LLE-AMC fluorogenic substrate measured for 1 hr b...


Eur J Med Chem 71: 290-305 (2014)


Article DOI: 10.1016/j.ejmech.2013.11.009
BindingDB Entry DOI: 10.7270/Q2222W81
More data for this
Ligand-Target Pair
20S proteasome chymotrypsin-like


(Homo sapiens (Human))
BDBM50444885
PNG
(CHEMBL3099637)
Show SMILES CC(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1
Show InChI InChI=1S/C30H44N2O2/c1-26(27-10-14-29(15-11-27)33-24-22-31-18-6-2-3-7-19-31)28-12-16-30(17-13-28)34-25-23-32-20-8-4-5-9-21-32/h10-17,26H,2-9,18-25H2,1H3
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Article
PubMed
n/an/a 800n/an/an/an/an/an/a



Institute of Bio-Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of chymotrypsin-like activity of human 20S proteasome beta 5 subunit assessed as hydrolysis of succinyl-LLVY-AMC fluorogenic substrate mea...


Eur J Med Chem 71: 290-305 (2014)


Article DOI: 10.1016/j.ejmech.2013.11.009
BindingDB Entry DOI: 10.7270/Q2222W81
More data for this
Ligand-Target Pair