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Compile Data Set for Download or QSAR

Found 153 hits with Last Name = 'bajusz' and Initial = 'd'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583252
PNG
(CHEMBL5077745)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
400n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583253
PNG
(CHEMBL5083897)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
920n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583244
PNG
(CHEMBL5072214)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)COCCOCCN)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.09E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583233
PNG
(CHEMBL5085890)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.82E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583249
PNG
(CHEMBL5071305)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.07E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583250
PNG
(CHEMBL5080018)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.12E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583251
PNG
(CHEMBL5074161)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.42E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583237
PNG
(CHEMBL5083791)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.46E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583235
PNG
(CHEMBL5078422)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.59E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583239
PNG
(CHEMBL5088751)
Show SMILES CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.75E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583241
PNG
(CHEMBL5086743)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](C)C(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.06E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583232
PNG
(CHEMBL5083288)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.13E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583236
PNG
(CHEMBL5088998)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
4.60E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583238
PNG
(CHEMBL5082530)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
4.87E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583248
PNG
(CHEMBL5089288)
Show SMILES NCCOCCOCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.01E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583234
PNG
(CHEMBL5091352)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.35E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Maternal embryonic leucine zipper kinase


(Homo sapiens (Human))
BDBM50553103
PNG
(CHEMBL4784866)
Show SMILES Nc1cccc2cc[nH]c(=O)c12
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
5.47E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of kinase tracer 236 from human N-terminal His-tagged MELK (1 to 337 residues) expressed in Escherichia coli BL21 pLysS by microscale th...


Citation and Details

Article DOI: 10.1039/c9md00519f
BindingDB Entry DOI: 10.7270/Q2TQ655W
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583242
PNG
(CHEMBL5091465)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)COCCOCCN)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.51E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583246
PNG
(CHEMBL5086289)
Show SMILES CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)COCCOCCN)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.88E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583240
PNG
(CHEMBL5081376)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
6.59E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583247
PNG
(CHEMBL5069480)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)COCCOCCN)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
7.64E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583243
PNG
(CHEMBL5084496)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)COCCOCCN)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
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1.44E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5


(Homo sapiens (Human))
BDBM50583245
PNG
(CHEMBL5080628)
Show SMILES NCCOCCOCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)NCC(O)=O |r|
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1.50E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TAM-3Y-F2Pmp peptide binding to N-terminal His6-fused STEP32 (282 to 563 residues) (unknown origin) expressed in Escherichia coli BL21(...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01303
BindingDB Entry DOI: 10.7270/Q24J0K1V
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607926
PNG
(CHEMBL5270127)
Show SMILES ClCC(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
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n/an/a 0.770n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607924
PNG
(CHEMBL5278864)
Show SMILES NC(=O)C(=C/c1cccc(c1)-c1ncnc2[nH]ccc12)\C#N
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607927
PNG
(CHEMBL5272677)
Show SMILES CC(Br)C(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50501537
PNG
(CHEMBL4085582)
Show SMILES C=CC(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C15H12N4O/c1-2-13(20)19-11-5-3-4-10(8-11)14-12-6-7-16-15(12)18-9-17-14/h2-9H,1H2,(H,19,20)(H,16,17,18)
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607926
PNG
(CHEMBL5270127)
Show SMILES ClCC(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607924
PNG
(CHEMBL5278864)
Show SMILES NC(=O)C(=C/c1cccc(c1)-c1ncnc2[nH]ccc12)\C#N
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607927
PNG
(CHEMBL5272677)
Show SMILES CC(Br)C(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
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Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50501537
PNG
(CHEMBL4085582)
Show SMILES C=CC(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C15H12N4O/c1-2-13(20)19-11-5-3-4-10(8-11)14-12-6-7-16-15(12)18-9-17-14/h2-9H,1H2,(H,19,20)(H,16,17,18)
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50501537
PNG
(CHEMBL4085582)
Show SMILES C=CC(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C15H12N4O/c1-2-13(20)19-11-5-3-4-10(8-11)14-12-6-7-16-15(12)18-9-17-14/h2-9H,1H2,(H,19,20)(H,16,17,18)
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Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607926
PNG
(CHEMBL5270127)
Show SMILES ClCC(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50355501
PNG
(INCB-018424 | RUXOLITINIB | RUXOLITINIB PHOSPHATE ...)
Show SMILES N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12 |r|
Show InChI InChI=1S/C17H18N6/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16/h6,8-12,15H,1-5H2,(H,19,20,21)/t15-/m1/s1
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n/an/a 2.80n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human JAK2 (828 to 1132 residues) expressed in baculovirus infected Sf9 insect cells using EQEDEPEGDYFEWLE as substrate after 1 hr by f...


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50355501
PNG
(INCB-018424 | RUXOLITINIB | RUXOLITINIB PHOSPHATE ...)
Show SMILES N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12 |r|
Show InChI InChI=1S/C17H18N6/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16/h6,8-12,15H,1-5H2,(H,19,20,21)/t15-/m1/s1
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n/an/a 3.30n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human JAK1 (837 to 1142 residues) expressed in baculovirus infected Sf9 insect cells using EQEDEPEGDYFEWLE as substrate after 1 hr by f...


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM185700
PNG
(US10875847, Compound Oclacitinib | US9161939, 1a |...)
Show SMILES CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2[nH]ccc12 |r,wU:9.12,wD:6.5,(5.44,3.81,;3.9,3.81,;2.56,3.04,;1.79,1.7,;3.33,1.7,;1.23,3.81,;-.1,3.04,;-1.44,3.81,;-2.77,3.04,;-2.77,1.5,;-1.44,.73,;-.1,1.5,;-4.1,.73,;-5.44,1.5,;-4.1,-.81,;-5.44,-1.58,;-5.44,-3.12,;-4.1,-3.89,;-2.77,-3.12,;-1.31,-3.6,;-.4,-2.35,;-1.31,-1.11,;-2.77,-1.58,)|
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n/an/a 10n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human recombinant JAK1 (852 to 1142 residues) by Z-Lyte assay


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607927
PNG
(CHEMBL5272677)
Show SMILES CC(Br)C(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
PDB

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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM185700
PNG
(US10875847, Compound Oclacitinib | US9161939, 1a |...)
Show SMILES CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2[nH]ccc12 |r,wU:9.12,wD:6.5,(5.44,3.81,;3.9,3.81,;2.56,3.04,;1.79,1.7,;3.33,1.7,;1.23,3.81,;-.1,3.04,;-1.44,3.81,;-2.77,3.04,;-2.77,1.5,;-1.44,.73,;-.1,1.5,;-4.1,.73,;-5.44,1.5,;-4.1,-.81,;-5.44,-1.58,;-5.44,-3.12,;-4.1,-3.89,;-2.77,-3.12,;-1.31,-3.6,;-.4,-2.35,;-1.31,-1.11,;-2.77,-1.58,)|
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n/an/a 18n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human recombinant JAK2 (808 to 1132 residues) by Z-Lyte assay


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50537335
PNG
(CHEMBL4559204)
Show SMILES Nc1n[nH]c2ccc(NC(=O)c3cc(Cl)ccc3Cl)cc12
Show InChI InChI=1S/C14H10Cl2N4O/c15-7-1-3-11(16)9(5-7)14(21)18-8-2-4-12-10(6-8)13(17)20-19-12/h1-6H,(H,18,21)(H3,17,19,20)
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n/an/a 23n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin) after 1 hr FRET-based Z'-Lyte assay


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
Maternal embryonic leucine zipper kinase


(Homo sapiens (Human))
BDBM50607924
PNG
(CHEMBL5278864)
Show SMILES NC(=O)C(=C/c1cccc(c1)-c1ncnc2[nH]ccc12)\C#N
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50537350
PNG
(CHEMBL4555943)
Show SMILES Nc1n[nH]c2ccc(cc12)C(=O)Nc1c(Cl)cccc1Cl
Show InChI InChI=1S/C14H10Cl2N4O/c15-9-2-1-3-10(16)12(9)18-14(21)7-4-5-11-8(6-7)13(17)20-19-11/h1-6H,(H,18,21)(H3,17,19,20)
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n/an/a 28n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin) after 1 hr FRET-based Z'-Lyte assay


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50537332
PNG
(CHEMBL4552462)
Show SMILES Nc1n[nH]c2ccc(cc12)C(=O)Nc1cc(Cl)ccc1Cl
Show InChI InChI=1S/C14H10Cl2N4O/c15-8-2-3-10(16)12(6-8)18-14(21)7-1-4-11-9(5-7)13(17)20-19-11/h1-6H,(H,18,21)(H3,17,19,20)
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n/an/a 38n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin) after 1 hr FRET-based Z'-Lyte assay


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607924
PNG
(CHEMBL5278864)
Show SMILES NC(=O)C(=C/c1cccc(c1)-c1ncnc2[nH]ccc12)\C#N
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n/an/a 56n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50607925
PNG
(CHEMBL5270221)
Show SMILES NC(=O)C(=C\c1cc(cc(c1)C(F)(F)F)C(F)(F)F)\C#N
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50537349
PNG
(CHEMBL4574380)
Show SMILES Nc1n[nH]c2ccc(NC(=O)c3ccccc3Cl)cc12
Show InChI InChI=1S/C14H11ClN4O/c15-11-4-2-1-3-9(11)14(20)17-8-5-6-12-10(7-8)13(16)19-18-12/h1-7H,(H,17,20)(H3,16,18,19)
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n/an/a 101n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin) after 1 hr FRET-based Z'-Lyte assay


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50537344
PNG
(CHEMBL4540569)
Show SMILES Nc1n[nH]c2ccc(cc12)C(=O)Nc1ccccc1Cl
Show InChI InChI=1S/C14H11ClN4O/c15-10-3-1-2-4-12(10)17-14(20)8-5-6-11-9(7-8)13(16)19-18-11/h1-7H,(H,17,20)(H3,16,18,19)
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n/an/a 126n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin) after 1 hr FRET-based Z'-Lyte assay


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50537335
PNG
(CHEMBL4559204)
Show SMILES Nc1n[nH]c2ccc(NC(=O)c3cc(Cl)ccc3Cl)cc12
Show InChI InChI=1S/C14H10Cl2N4O/c15-7-1-3-11(16)9(5-7)14(21)18-8-2-4-12-10(6-8)13(17)20-19-12/h1-6H,(H,18,21)(H3,17,19,20)
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n/an/a 151n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin) after 1 hr by FRET-based Z'-Lyte assay


Bioorg Med Chem 27: 1497-1508 (2019)


Article DOI: 10.1016/j.bmc.2019.02.029
BindingDB Entry DOI: 10.7270/Q2B27ZSZ
More data for this
Ligand-Target Pair
Maternal embryonic leucine zipper kinase


(Homo sapiens (Human))
BDBM50607928
PNG
(CHEMBL5287531)
Show SMILES CC(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12
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Citation and Details
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 4


(Homo sapiens (Human))
BDBM50607924
PNG
(CHEMBL5278864)
Show SMILES NC(=O)C(=C/c1cccc(c1)-c1ncnc2[nH]ccc12)\C#N
PDB
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PC cid
PC sid
UniChem
n/an/a 281n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM50607924
PNG
(CHEMBL5278864)
Show SMILES NC(=O)C(=C/c1cccc(c1)-c1ncnc2[nH]ccc12)\C#N
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 399n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
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