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Compile Data Set for Download or QSAR

Found 9 hits of ki data for polymerid = 50005949,50006462   
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
Serine racemase


(Mus musculus)
BDBM50038343
PNG
(CHEMBL3360546)
Show SMILES [Na+].[Na+].[O-]C(=O)C(Cl)(Cl)C([O-])=O
Show InChI InChI=1S/C3H2Cl2O4.2Na/c4-3(5,1(6)7)2(8)9;;/h(H,6,7)(H,8,9);;/q;2*+1/p-2
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1.90E+4n/an/an/an/an/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Inhibition of mouse serine racemase by Lineweaver-Burk plot


Eur J Med Chem 89: 189-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.10.043
BindingDB Entry DOI: 10.7270/Q22N53WK
More data for this
Ligand-Target Pair
Serine racemase


(Mus musculus)
BDBM14673
PNG
(Fragment 3 | Malonic Acid | propanedioic acid)
Show SMILES OC(=O)CC(O)=O
Show InChI InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)
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2.70E+4n/an/an/an/an/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Inhibition of mouse serine racemase by Lineweaver-Burk plot


Eur J Med Chem 89: 189-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.10.043
BindingDB Entry DOI: 10.7270/Q22N53WK
More data for this
Ligand-Target Pair
Serine racemase


(Mus musculus)
BDBM50378533
PNG
(CHEMBL568192)
Show SMILES N[C@H]([C@H](O)C(O)=O)C(O)=O
Show InChI InChI=1S/C4H7NO5/c5-1(3(7)8)2(6)4(9)10/h1-2,6H,5H2,(H,7,8)(H,9,10)/t1-,2+/m1/s1
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4.30E+4n/an/an/an/an/an/an/an/a



Institute of Organic Chemistry and Biochemistry of the ASCR

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant serine racemase transfected in bacterial expression system


J Med Chem 52: 6032-41 (2009)


Article DOI: 10.1021/jm900775q
BindingDB Entry DOI: 10.7270/Q29G5NRV
More data for this
Ligand-Target Pair
Serine racemase


(Mus musculus)
BDBM14673
PNG
(Fragment 3 | Malonic Acid | propanedioic acid)
Show SMILES OC(=O)CC(O)=O
Show InChI InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)
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7.10E+4n/an/an/an/an/an/an/an/a



Institute of Organic Chemistry and Biochemistry of the ASCR

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant serine racemase transfected in bacterial expression system


J Med Chem 52: 6032-41 (2009)


Article DOI: 10.1021/jm900775q
BindingDB Entry DOI: 10.7270/Q29G5NRV
More data for this
Ligand-Target Pair
Serine racemase


(Mus musculus)
BDBM50378532
PNG
(CHEMBL569435)
Show SMILES ONC(=O)CC(=O)NO
Show InChI InChI=1S/C3H6N2O4/c6-2(4-8)1-3(7)5-9/h8-9H,1H2,(H,4,6)(H,5,7)
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4.17E+5n/an/an/an/an/an/an/an/a



Institute of Organic Chemistry and Biochemistry of the ASCR

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant serine racemase expressed in Escherichia coli MC1061 assessed as formation of D-serine after 30 mins by Linewaver-bur...


J Med Chem 52: 6032-41 (2009)


Article DOI: 10.1021/jm900775q
BindingDB Entry DOI: 10.7270/Q29G5NRV
More data for this
Ligand-Target Pair
Serine racemase


(Mus musculus)
BDBM50378534
PNG
(CHEMBL216796)
Show SMILES NCC(=O)NO
Show InChI InChI=1S/C2H6N2O2/c3-1-2(5)4-6/h6H,1,3H2,(H,4,5)
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1.64E+6n/an/an/an/an/an/an/an/a



Institute of Organic Chemistry and Biochemistry of the ASCR

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant serine racemase transfected in bacterial expression system


J Med Chem 52: 6032-41 (2009)


Article DOI: 10.1021/jm900775q
BindingDB Entry DOI: 10.7270/Q29G5NRV
More data for this
Ligand-Target Pair
Serine racemase


(Mus musculus)
BDBM50129194
PNG
((2S)-2-amino-4-(hydroxyamino)-4-oxobutanoic acidN(...)
Show SMILES N[C@@H](CC(=O)NO)C(O)=O
Show InChI InChI=1S/C4H8N2O4/c5-2(4(8)9)1-3(7)6-10/h2,10H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1
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1.90E+6n/an/an/an/an/an/an/an/a



Institute of Organic Chemistry and Biochemistry of the ASCR

Curated by ChEMBL


Assay Description
Inhibition of mouse brain serine racemase


J Med Chem 52: 6032-41 (2009)


Article DOI: 10.1021/jm900775q
BindingDB Entry DOI: 10.7270/Q29G5NRV
More data for this
Ligand-Target Pair
Serine racemase


(Schizosaccharomyces pombe (strain 972 / ATCC 24843...)
BDBM50444848
PNG
(CHEMBL3099359)
Show SMILES [NH3+]C(CO)(CO)C([O-])=O
Show InChI InChI=1S/C4H9NO4/c5-4(1-6,2-7)3(8)9/h6-7H,1-2,5H2,(H,8,9)
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1.67E+8n/an/an/an/an/an/an/an/a



Dalhousie University

Curated by ChEMBL


Assay Description
Mixed type inhibition of N-terminal 6xHis-tagged recombinant Schizosaccharomyces pombe 972 serine racemase expressed in Escherichia coli BL21(DE3) us...


Bioorg Med Chem Lett 24: 390-3 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.061
BindingDB Entry DOI: 10.7270/Q2PV6MVC
More data for this
Ligand-Target Pair
Serine racemase


(Schizosaccharomyces pombe (strain 972 / ATCC 24843...)
BDBM50444848
PNG
(CHEMBL3099359)
Show SMILES [NH3+]C(CO)(CO)C([O-])=O
Show InChI InChI=1S/C4H9NO4/c5-4(1-6,2-7)3(8)9/h6-7H,1-2,5H2,(H,8,9)
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6.61E+8n/an/an/an/an/an/an/an/a



Dalhousie University

Curated by ChEMBL


Assay Description
Mixed type inhibition of N-terminal 6xHis-tagged recombinant Schizosaccharomyces pombe 972 serine racemase expressed in Escherichia coli BL21(DE3) us...


Bioorg Med Chem Lett 24: 390-3 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.061
BindingDB Entry DOI: 10.7270/Q2PV6MVC
More data for this
Ligand-Target Pair