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Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
pH (Enzymatic Assay)
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Target Names &
Ki
IC50
Kd
EC50
ΔG°
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Deposition
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null
SMILES:
COc1cc(nc2c(C)c3nc(cc(OC)c3cc12)C(O)=O)C(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
5
hits for monomerid = 50575550
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
G-protein coupled receptor 35
(Homo sapiens (Human))
BDBM50575550
(CHEMBL4852667)
Show SMILES
COc1cc(nc2c(C)c3nc(cc(OC)c3cc12)C(O)=O)C(O)=O
Show InChI
PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
n/a
n/a
100
n/a
n/a
n/a
n/a
TBA
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c01624
BindingDB Entry DOI:
10.7270/Q2T72N8P
More data for this
Ligand-Target Pair
G-protein coupled receptor 35
(Homo sapiens (Human))
BDBM50575550
(CHEMBL4852667)
Show SMILES
COc1cc(nc2c(C)c3nc(cc(OC)c3cc12)C(O)=O)C(O)=O
Show InChI
PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
65
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c01624
BindingDB Entry DOI:
10.7270/Q2T72N8P
More data for this
Ligand-Target Pair
G-protein coupled receptor 35
(Homo sapiens (Human))
BDBM50575550
(CHEMBL4852667)
Show SMILES
COc1cc(nc2c(C)c3nc(cc(OC)c3cc12)C(O)=O)C(O)=O
Show InChI
PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
6.10
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c01624
BindingDB Entry DOI:
10.7270/Q2T72N8P
More data for this
Ligand-Target Pair
G-protein coupled receptor 35
(Homo sapiens (Human))
BDBM50575550
(CHEMBL4852667)
Show SMILES
COc1cc(nc2c(C)c3nc(cc(OC)c3cc12)C(O)=O)C(O)=O
Show InChI
PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
n/a
n/a
8.10
n/a
n/a
n/a
n/a
TBA
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c01624
BindingDB Entry DOI:
10.7270/Q2T72N8P
More data for this
Ligand-Target Pair
G-protein coupled receptor 35
(Homo sapiens (Human))
BDBM50575550
(CHEMBL4852667)
Show SMILES
COc1cc(nc2c(C)c3nc(cc(OC)c3cc12)C(O)=O)C(O)=O
Show InChI
PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
282
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c01624
BindingDB Entry DOI:
10.7270/Q2T72N8P
More data for this
Ligand-Target Pair
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