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Target
Sequence
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Ki
IC50
Kd
EC50
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Ki
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Compile Data Set for Download or QSAR
Found
4
hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50015987
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
pH
Temp
°C
LIM domain kinase 1
(Homo sapiens (Human))
BDBM50591082
(CHEMBL4790618)
Show SMILES
CCCCN(Cc1ccccc1)C(=O)c1ccc(cc1)S(=O)(=O)Nc1ccccc1
Show InChI
PDB
Reactome pathway
KEGG
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antibodypedia
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AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
n/a
64
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
Article DOI:
10.1021/acs.jmedchem.2c01106
BindingDB Entry DOI:
10.7270/Q23R0XVH
More data for this
Ligand-Target Pair
LIM domain kinase 1
(Homo sapiens (Human))
BDBM50591084
(CHEMBL5186508)
Show SMILES
CCCN(Cc1ccccc1)C(=O)c1ccc(cc1)S(=O)(=O)Nc1cccc(Cl)c1
Show InChI
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/a
n/a
n/a
386
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
Article DOI:
10.1021/acs.jmedchem.2c01106
BindingDB Entry DOI:
10.7270/Q23R0XVH
More data for this
Ligand-Target Pair
LIM domain kinase 1
(Homo sapiens (Human))
BDBM50591083
(CHEMBL5184281)
Show SMILES
CCCN(Cc1ccccc1)C(=O)c1ccc(cc1)S(=O)(=O)Nc1ccccc1
Show InChI
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
n/a
89
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
Article DOI:
10.1021/acs.jmedchem.2c01106
BindingDB Entry DOI:
10.7270/Q23R0XVH
More data for this
Ligand-Target Pair
LIM domain kinase 1
(Homo sapiens (Human))
BDBM50043510
(CHEMBL3355507)
Show SMILES
CCN(Cc1ccccc1)C(=O)c1ccc(cc1)S(=O)(=O)Nc1ccccc1
Show InChI
InChI=1S/C22H22N2O3S/c1-2-24(17-18-9-5-3-6-10-18)22(25)19-13-15-21(16-14-19)28(26,27)23-20-11-7-4-8-12-20/h3-16,23H,2,17H2,1H3
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
Article
PubMed
n/a
n/a
n/a
53
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
Article DOI:
10.1021/acs.jmedchem.2c01106
BindingDB Entry DOI:
10.7270/Q23R0XVH
More data for this
Ligand-Target Pair
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