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Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
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Ki
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null
SMILES:
OB(O)CCC[C@@H]1[C@@H](O)CN[C@@H]1C(O)=O
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 = 50561036
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
Arginase-1
(Homo sapiens (Human))
BDBM50561036
(CHEMBL4778978)
Show SMILES
OB(O)CCC[C@@H]1[C@@H](O)CN[C@@H]1C(O)=O |r|
Show InChI
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
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DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
6
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of human Arg1 by TOGA assay
Citation and Details
Article DOI:
10.1016/j.bmc.2020.115658
BindingDB Entry DOI:
10.7270/Q2WS8XZC
More data for this
Ligand-Target Pair
Arginase-1
(Homo sapiens (Human))
BDBM50561036
(CHEMBL4778978)
Show SMILES
OB(O)CCC[C@@H]1[C@@H](O)CN[C@@H]1C(O)=O |r|
Show InChI
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
n/a
n/a
6.90E+3
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of human ARG1 in HEK293 cells by cell based assay
Citation and Details
Article DOI:
10.1021/acsmedchemlett.1c00195
BindingDB Entry DOI:
10.7270/Q2542SD6
More data for this
Ligand-Target Pair
Arginase-1
(Homo sapiens (Human))
BDBM50561036
(CHEMBL4778978)
Show SMILES
OB(O)CCC[C@@H]1[C@@H](O)CN[C@@H]1C(O)=O |r|
Show InChI
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of human recombinant ARG1 expressed in Escherichia coli using thioarginine as a substrate preincubated for 30 mins followed by substrate a...
Citation and Details
Article DOI:
10.1021/acsmedchemlett.1c00195
BindingDB Entry DOI:
10.7270/Q2542SD6
More data for this
Ligand-Target Pair
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