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Compile Data Set for Download or QSAR

Found 3 hits of ic50 for monomerid = 50296392   
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 1


(Homo sapiens (Human))
BDBM50296392
PNG
((2S)-3-(4-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxa...)
Show SMILES CCCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r|
Show InChI InChI=1S/C20H29NO4S2/c1-2-12-25-18(20(23)24)14-15-7-9-16(10-8-15)21-19(22)6-4-3-5-17-11-13-26-27-17/h7-10,17-18H,2-6,11-14H2,1H3,(H,21,22)(H,23,24)/t17-,18+/m1/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 374n/an/an/an/an/an/a



Glenmark Research Center

Curated by ChEMBL


Assay Description
Inhibition of PTP1B


Eur J Med Chem 44: 3147-57 (2009)


Article DOI: 10.1016/j.ejmech.2009.03.009
BindingDB Entry DOI: 10.7270/Q2FJ2GTG
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM50296392
PNG
((2S)-3-(4-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxa...)
Show SMILES CCCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r|
Show InChI InChI=1S/C20H29NO4S2/c1-2-12-25-18(20(23)24)14-15-7-9-16(10-8-15)21-19(22)6-4-3-5-17-11-13-26-27-17/h7-10,17-18H,2-6,11-14H2,1H3,(H,21,22)(H,23,24)/t17-,18+/m1/s1
PDB
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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.47E+3n/an/an/an/an/an/a



Glenmark Research Center

Curated by ChEMBL


Assay Description
Inhibition of TCPTP


Eur J Med Chem 44: 3147-57 (2009)


Article DOI: 10.1016/j.ejmech.2009.03.009
BindingDB Entry DOI: 10.7270/Q2FJ2GTG
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein phosphatase F


(Homo sapiens (Human))
BDBM50296392
PNG
((2S)-3-(4-{4-[(3R)-1,2-Dithiolan-3-yl]butylcarboxa...)
Show SMILES CCCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r|
Show InChI InChI=1S/C20H29NO4S2/c1-2-12-25-18(20(23)24)14-15-7-9-16(10-8-15)21-19(22)6-4-3-5-17-11-13-26-27-17/h7-10,17-18H,2-6,11-14H2,1H3,(H,21,22)(H,23,24)/t17-,18+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.98E+3n/an/an/an/an/an/a



Glenmark Research Center

Curated by ChEMBL


Assay Description
Inhibition of LAR


Eur J Med Chem 44: 3147-57 (2009)


Article DOI: 10.1016/j.ejmech.2009.03.009
BindingDB Entry DOI: 10.7270/Q2FJ2GTG
More data for this
Ligand-Target Pair