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BDBM50065790 (E)-2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-carboxylic acid::2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-carboxylic acid::2-[(E)-2-(2,4-Dihydroxy-phenyl)-vinyl]-8-hydroxy-quinoline-7-carboxylic acid::2-[2-(2,4-Dihydroxy-phenyl)-vinyl]-8-hydroxy-quinoline-7-carboxylic acid::CHEMBL36586

SMILES: OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O

InChI Key: InChIKey=CPDSFOPJYPRZMV-ORCRQEGFSA-N

Data: 8 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50065790   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Integrase


(Human immunodeficiency virus 1)
BDBM50065790
PNG
((E)-2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-c...)
Show SMILES OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O
Show InChI InChI=1S/C18H13NO5/c20-13-7-3-10(15(21)9-13)1-5-12-6-2-11-4-8-14(18(23)24)17(22)16(11)19-12/h1-9,20-22H,(H,23,24)/b5-1+
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 2.80E+3n/an/an/an/an/an/a



Université Paris-Sud

Curated by ChEMBL


Assay Description
In vitro anti-HIV integrase activity of the compound was tested against integration(strand transfer) of target plasmid.


J Med Chem 41: 2846-57 (1998)


Article DOI: 10.1021/jm980043e
BindingDB Entry DOI: 10.7270/Q21Z43JH
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50065790
PNG
((E)-2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-c...)
Show SMILES OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O
Show InChI InChI=1S/C18H13NO5/c20-13-7-3-10(15(21)9-13)1-5-12-6-2-11-4-8-14(18(23)24)17(22)16(11)19-12/h1-9,20-22H,(H,23,24)/b5-1+
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 3.70E+3n/an/an/an/an/an/a



Université Paris-Sud

Curated by ChEMBL


Assay Description
HIV integrase inhibitory potency of the compound was evaluated as IC50 on 3' processing of target DNA.


J Med Chem 41: 2846-57 (1998)


Article DOI: 10.1021/jm980043e
BindingDB Entry DOI: 10.7270/Q21Z43JH
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50065790
PNG
((E)-2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-c...)
Show SMILES OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O
Show InChI InChI=1S/C18H13NO5/c20-13-7-3-10(15(21)9-13)1-5-12-6-2-11-4-8-14(18(23)24)17(22)16(11)19-12/h1-9,20-22H,(H,23,24)/b5-1+
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

PubMed
n/an/a 2.80E+3n/an/an/an/an/an/a



Université Paris-Sud

Curated by ChEMBL


Assay Description
Inhibitory activity against Integrase in strand transfer(integration)


J Med Chem 43: 1533-40 (2000)


BindingDB Entry DOI: 10.7270/Q2JS9PNQ
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50065790
PNG
((E)-2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-c...)
Show SMILES OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O
Show InChI InChI=1S/C18H13NO5/c20-13-7-3-10(15(21)9-13)1-5-12-6-2-11-4-8-14(18(23)24)17(22)16(11)19-12/h1-9,20-22H,(H,23,24)/b5-1+
PDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 3.72E+3n/an/an/an/an/an/a



Jadavpur University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 integrase 3' processing activity


Eur J Med Chem 43: 81-92 (2008)


Article DOI: 10.1016/j.ejmech.2007.02.021
BindingDB Entry DOI: 10.7270/Q24170XZ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM50065790
PNG
((E)-2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-c...)
Show SMILES OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O
Show InChI InChI=1S/C18H13NO5/c20-13-7-3-10(15(21)9-13)1-5-12-6-2-11-4-8-14(18(23)24)17(22)16(11)19-12/h1-9,20-22H,(H,23,24)/b5-1+
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 500n/an/an/an/an/an/a



Universit£ Paris Sud

Curated by ChEMBL


Assay Description
Inhibition of PIM1


Bioorg Med Chem Lett 20: 2801-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.061
BindingDB Entry DOI: 10.7270/Q2125STS
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50065790
PNG
((E)-2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-c...)
Show SMILES OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O
Show InChI InChI=1S/C18H13NO5/c20-13-7-3-10(15(21)9-13)1-5-12-6-2-11-4-8-14(18(23)24)17(22)16(11)19-12/h1-9,20-22H,(H,23,24)/b5-1+
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



CNRS UMR 8532

Curated by ChEMBL


Assay Description
Inhibition of human immunodeficiency virus-1 (HIV-1) integrase.


J Med Chem 43: 1949-57 (2000)

Checked by Author
BindingDB Entry DOI: 10.7270/Q2RB759N
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Rous sarcoma virus (strain Prague C) (RSV-PrC))
BDBM50065790
PNG
((E)-2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-c...)
Show SMILES OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O
Show InChI InChI=1S/C18H13NO5/c20-13-7-3-10(15(21)9-13)1-5-12-6-2-11-4-8-14(18(23)24)17(22)16(11)19-12/h1-9,20-22H,(H,23,24)/b5-1+
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 3.83E+4n/an/an/an/an/an/a



CNRS UMR 8532

Curated by ChEMBL


Assay Description
Inhibition of rous sarcoma virus (RSV) Integrase.


J Med Chem 43: 1949-57 (2000)

Checked by Author
BindingDB Entry DOI: 10.7270/Q2RB759N
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50065790
PNG
((E)-2-(2,4-dihydroxystyryl)-8-hydroxyquinoline-7-c...)
Show SMILES OC(=O)c1ccc2ccc(\C=C\c3ccc(O)cc3O)nc2c1O
Show InChI InChI=1S/C18H13NO5/c20-13-7-3-10(15(21)9-13)1-5-12-6-2-11-4-8-14(18(23)24)17(22)16(11)19-12/h1-9,20-22H,(H,23,24)/b5-1+
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

PubMed
n/an/a 3.70E+3n/an/an/an/an/an/a



Université Paris-Sud

Curated by ChEMBL


Assay Description
Inhibitory activity against Integrase in 3'-end- processing


J Med Chem 43: 1533-40 (2000)


BindingDB Entry DOI: 10.7270/Q2JS9PNQ
More data for this
Ligand-Target Pair