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Target
Sequence
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&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
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null
SMILES:
OC(=O)C1(CCCCC1)NC(=O)c1cccc2cc(oc12)-c1ccc(Cl)cc1
InChI Key:
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 = 50571872
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
pH
Temp
°C
Endoplasmic reticulum aminopeptidase 1
(Homo sapiens (Human))
BDBM50571872
(CHEMBL4864508)
Show SMILES
OC(=O)C1(CCCCC1)NC(=O)c1cccc2cc(oc12)-c1ccc(Cl)cc1
Show InChI
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
120
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of wild type ERAP1 (unknown origin) using L-Rho-Succ-FKARKF as substrate preincubated for 15 mins followed by substrate addition and measu...
Citation and Details
Article DOI:
10.1021/acsmedchemlett.1c00235
BindingDB Entry DOI:
10.7270/Q2QJ7N22
More data for this
Ligand-Target Pair
Aminopeptidase N
(Homo sapiens (Human))
BDBM50571872
(CHEMBL4864508)
Show SMILES
OC(=O)C1(CCCCC1)NC(=O)c1cccc2cc(oc12)-c1ccc(Cl)cc1
Show InChI
PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
>3.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of APN (unknown origin) using Ala-AMC as substrate
Citation and Details
Article DOI:
10.1021/acsmedchemlett.1c00235
BindingDB Entry DOI:
10.7270/Q2QJ7N22
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 2
(Homo sapiens (Human))
BDBM50571872
(CHEMBL4864508)
Show SMILES
OC(=O)C1(CCCCC1)NC(=O)c1cccc2cc(oc12)-c1ccc(Cl)cc1
Show InChI
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
>3.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of ERAP2 (unknown origin) using Arg-AMC as substrate
Citation and Details
Article DOI:
10.1021/acsmedchemlett.1c00235
BindingDB Entry DOI:
10.7270/Q2QJ7N22
More data for this
Ligand-Target Pair
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