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Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
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Found
24
hits Enz. Inhib. hit(s) with all data for entry = 50014505
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
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576941
(CHEMBL4875137)
Show SMILES
Cc1ccccc1-c1nc2c(N)ncn(Cc3c(Cl)cncc3Cl)c2n1
Show InChI
PDB
UniProtKB/SwissProt
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 recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576927
(CHEMBL4856707)
Show SMILES
Cc1ccccc1-c1nc2c(N)ncn(Cc3c(Cl)cccc3Cl)c2n1
Show InChI
PDB
UniProtKB/SwissProt
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GoogleScholar
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PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/a
n/a
20
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
3D Structure (crystal)
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576940
(CHEMBL4857535)
Show SMILES
Nc1ncn(Cc2c(Cl)cncc2Cl)c2ncnc12
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
83
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576928
(CHEMBL4855952)
Show SMILES
Cc1cccc(c1)-c1nc2c(N)ncn(Cc3c(Cl)cccc3Cl)c2n1
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
87
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576921
(CHEMBL4874911)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(nc12)-c1ccccc1
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
104
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576933
(CHEMBL4848127)
Show SMILES
COc1ccccc1-c1nc2c(N)ncn(Cc3c(Cl)cccc3Cl)c2n1
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
106
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576932
(CHEMBL4873827)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(nc12)-c1ccc(F)cc1
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
117
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576929
(CHEMBL4859307)
Show SMILES
Cc1ccc(cc1)-c1nc2c(N)ncn(Cc3c(Cl)cccc3Cl)c2n1
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
119
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576930
(CHEMBL4858034)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(nc12)-c1ccccc1F
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
147
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576924
(CHEMBL4861843)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(nc12)-c1ccccc1Cl
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
171
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576919
(CHEMBL4847980)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2ncnc12
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
239
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576931
(CHEMBL4870698)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(nc12)-c1cccc(F)c1
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
239
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576934
(CHEMBL4868378)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(nc12)-c1ccccc1C#N
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
245
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576926
(CHEMBL4857590)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(nc12)-c1ccc(Cl)cc1
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
288
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576920
(CHEMBL4852414)
Show SMILES
Cc1nc2c(N)ncn(Cc3c(Cl)cccc3Cl)c2n1
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
306
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576925
(CHEMBL4846731)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(nc12)-c1cccc(Cl)c1
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
380
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576936
(CHEMBL3228665)
Show SMILES
Nc1ncn(Cc2ccc(Cl)cc2Cl)c2ncnc12
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.02E+3
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576935
(CHEMBL3228662)
Show SMILES
Nc1ncn(Cc2ccccc2Cl)c2ncnc12
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.93E+3
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576939
(CHEMBL4851570)
Show SMILES
Cc1cccc(C)c1Cn1cnc(N)c2ncnc12
Show InChI
PDB
UniProtKB/SwissProt
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GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
3.43E+3
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50488844
(3-BENZYLADENINE)
Show SMILES
Nc1ncn(Cc2ccccc2)c2ncnc12
Show InChI
InChI=1S/C12H11N5/c13-11-10-12(15-7-14-10)17(8-16-11)6-9-4-2-1-3-5-9/h1-5,7-8H,6,13H2
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
Purchase
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.36E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576922
(CHEMBL4865769)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(Br)nc12
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.76E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576937
(CHEMBL3228663)
Show SMILES
Nc1ncn(Cc2cccc(Cl)c2)c2ncnc12
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.85E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576938
(CHEMBL3228664)
Show SMILES
Nc1ncn(Cc2ccc(Cl)cc2)c2ncnc12
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.94E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase
(Homo sapiens (Human))
BDBM50576923
(CHEMBL4863777)
Show SMILES
Nc1ncn(Cc2c(Cl)cccc2Cl)c2nc(Cl)nc12
Show InChI
PDB
UniProtKB/SwissProt
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PC sid
UniChem
Article
PubMed
n/a
n/a
2.78E+4
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of recombinant human LMPTP-A using OMFP or pNPP as substrate by fluorescence assay
Citation and Details
Article DOI:
10.1021/acs.jmedchem.0c02126
BindingDB Entry DOI:
10.7270/Q21G0R2R
More data for this
Ligand-Target Pair
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