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Compile Data Set for Download or QSAR

Found 6 hits of ic50 for monomerid = 50237838   
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
Integrase


(Human immunodeficiency virus 1)
BDBM50237838
PNG
((R)-3-(4,5-dihydroxy-2-nitrophenyl)-2-(3-(4,5-dihy...)
Show SMILES OC(=O)[C@@H](Cc1cc(O)c(O)cc1[N+]([O-])=O)OC(=O)\C=C\c1cc(O)c(O)cc1[N+]([O-])=O
Show InChI InChI=1S/C18H14N2O12/c21-12-3-8(10(19(28)29)6-14(12)23)1-2-17(25)32-16(18(26)27)5-9-4-13(22)15(24)7-11(9)20(30)31/h1-4,6-7,16,21-24H,5H2,(H,26,27)/b2-1+/t16-/m1/s1
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 30n/an/an/an/an/an/a



Universit£ de Lille 1

Curated by ChEMBL


Assay Description
Inhibition of HIV1 integrase using labelled U5A/U5B double stranded DNA substrate


J Med Chem 51: 2575-9 (2008)


Article DOI: 10.1021/jm7011134
BindingDB Entry DOI: 10.7270/Q26M39K5
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50237838
PNG
((R)-3-(4,5-dihydroxy-2-nitrophenyl)-2-(3-(4,5-dihy...)
Show SMILES OC(=O)[C@@H](Cc1cc(O)c(O)cc1[N+]([O-])=O)OC(=O)\C=C\c1cc(O)c(O)cc1[N+]([O-])=O
Show InChI InChI=1S/C18H14N2O12/c21-12-3-8(10(19(28)29)6-14(12)23)1-2-17(25)32-16(18(26)27)5-9-4-13(22)15(24)7-11(9)20(30)31/h1-4,6-7,16,21-24H,5H2,(H,26,27)/b2-1+/t16-/m1/s1
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 70n/an/an/an/an/an/a



Universit£ de Lille 1

Curated by ChEMBL


Assay Description
Inhibition of HIV1 integrase strand transfer activity using labelled oligonucleotide substrate by ELISA


J Med Chem 51: 2575-9 (2008)


Article DOI: 10.1021/jm7011134
BindingDB Entry DOI: 10.7270/Q26M39K5
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50237838
PNG
((R)-3-(4,5-dihydroxy-2-nitrophenyl)-2-(3-(4,5-dihy...)
Show SMILES OC(=O)[C@@H](Cc1cc(O)c(O)cc1[N+]([O-])=O)OC(=O)\C=C\c1cc(O)c(O)cc1[N+]([O-])=O
Show InChI InChI=1S/C18H14N2O12/c21-12-3-8(10(19(28)29)6-14(12)23)1-2-17(25)32-16(18(26)27)5-9-4-13(22)15(24)7-11(9)20(30)31/h1-4,6-7,16,21-24H,5H2,(H,26,27)/b2-1+/t16-/m1/s1
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 150n/an/an/an/an/an/a



Universit£ de Lille 1

Curated by ChEMBL


Assay Description
Inhibition of HIV1 integrase using labelled oligonucleotide substrate by ELISA


J Med Chem 51: 2575-9 (2008)


Article DOI: 10.1021/jm7011134
BindingDB Entry DOI: 10.7270/Q26M39K5
More data for this
Ligand-Target Pair
Aldo-keto reductase family 1 member B1


(Homo sapiens (Human))
BDBM50237838
PNG
((R)-3-(4,5-dihydroxy-2-nitrophenyl)-2-(3-(4,5-dihy...)
Show SMILES OC(=O)[C@@H](Cc1cc(O)c(O)cc1[N+]([O-])=O)OC(=O)\C=C\c1cc(O)c(O)cc1[N+]([O-])=O
Show InChI InChI=1S/C18H14N2O12/c21-12-3-8(10(19(28)29)6-14(12)23)1-2-17(25)32-16(18(26)27)5-9-4-13(22)15(24)7-11(9)20(30)31/h1-4,6-7,16,21-24H,5H2,(H,26,27)/b2-1+/t16-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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CHEMBL
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PC sid
UniChem

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Article
PubMed
n/an/a 741n/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase


Eur J Med Chem 45: 1663-6 (2010)


Article DOI: 10.1016/j.ejmech.2009.12.007
BindingDB Entry DOI: 10.7270/Q2N58MJW
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50237838
PNG
((R)-3-(4,5-dihydroxy-2-nitrophenyl)-2-(3-(4,5-dihy...)
Show SMILES OC(=O)[C@@H](Cc1cc(O)c(O)cc1[N+]([O-])=O)OC(=O)\C=C\c1cc(O)c(O)cc1[N+]([O-])=O
Show InChI InChI=1S/C18H14N2O12/c21-12-3-8(10(19(28)29)6-14(12)23)1-2-17(25)32-16(18(26)27)5-9-4-13(22)15(24)7-11(9)20(30)31/h1-4,6-7,16,21-24H,5H2,(H,26,27)/b2-1+/t16-/m1/s1
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 2.08E+4n/an/an/an/an/an/a



Universit£ de Lille 1

Curated by ChEMBL


Assay Description
Inhibition of HIV1 integrase using labelled oligonucleotide substrate in presence of bovine serum albumin by ELISA


J Med Chem 51: 2575-9 (2008)


Article DOI: 10.1021/jm7011134
BindingDB Entry DOI: 10.7270/Q26M39K5
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50237838
PNG
((R)-3-(4,5-dihydroxy-2-nitrophenyl)-2-(3-(4,5-dihy...)
Show SMILES OC(=O)[C@@H](Cc1cc(O)c(O)cc1[N+]([O-])=O)OC(=O)\C=C\c1cc(O)c(O)cc1[N+]([O-])=O
Show InChI InChI=1S/C18H14N2O12/c21-12-3-8(10(19(28)29)6-14(12)23)1-2-17(25)32-16(18(26)27)5-9-4-13(22)15(24)7-11(9)20(30)31/h1-4,6-7,16,21-24H,5H2,(H,26,27)/b2-1+/t16-/m1/s1
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.22E+4n/an/an/an/an/an/a



Universit£ de Lille 1

Curated by ChEMBL


Assay Description
Inhibition of HIV1 integrase 3'-processing activity using labelled oligonucleotide substrate by ELISA


J Med Chem 51: 2575-9 (2008)


Article DOI: 10.1021/jm7011134
BindingDB Entry DOI: 10.7270/Q26M39K5
More data for this
Ligand-Target Pair