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BDBM50056926 4,10-Dihydroxy-[1,7]phenanthroline-3,9-dicarboxylic acid::4,10-dihydroxypyrido[2,3-f]quinoline-3,9-dicarboxylate::CHEMBL369379::NSC-128884

SMILES: OC(=O)c1cnc2c(ccc3ncc(C(O)=O)c(O)c23)c1O

InChI Key: InChIKey=GIFCDUXKRJFRTJ-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50056926   
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
Human immunodeficiency virus type 1 integrase


(Human immunodeficiency virus 1)
BDBM50056926
PNG
(4,10-Dihydroxy-[1,7]phenanthroline-3,9-dicarboxyli...)
Show SMILES OC(=O)c1cnc2c(ccc3ncc(C(O)=O)c(O)c23)c1O
Show InChI InChI=1S/C14H8N2O6/c17-11-5-1-2-8-9(10(5)16-4-6(11)13(19)20)12(18)7(3-15-8)14(21)22/h1-4H,(H,15,18)(H,16,17)(H,19,20)(H,21,22)
PDB
MMDB

UniProtKB/TrEMBL

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

Patents


Similars

Article
PubMed
n/an/a 7.60E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against 3'-processing of HIV-1 integrase in experiment 1


J Med Chem 40: 942-51 (1997)


Article DOI: 10.1021/jm960759e
BindingDB Entry DOI: 10.7270/Q2NK3FPV
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 integrase


(Human immunodeficiency virus 1)
BDBM50056926
PNG
(4,10-Dihydroxy-[1,7]phenanthroline-3,9-dicarboxyli...)
Show SMILES OC(=O)c1cnc2c(ccc3ncc(C(O)=O)c(O)c23)c1O
Show InChI InChI=1S/C14H8N2O6/c17-11-5-1-2-8-9(10(5)16-4-6(11)13(19)20)12(18)7(3-15-8)14(21)22/h1-4H,(H,15,18)(H,16,17)(H,19,20)(H,21,22)
PDB
MMDB

UniProtKB/TrEMBL

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

Patents


Similars

Article
PubMed
n/an/a 6.10E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against 3'-processing of HIV-1 integrase in experiment 2


J Med Chem 40: 942-51 (1997)


Article DOI: 10.1021/jm960759e
BindingDB Entry DOI: 10.7270/Q2NK3FPV
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 integrase


(Human immunodeficiency virus 1)
BDBM50056926
PNG
(4,10-Dihydroxy-[1,7]phenanthroline-3,9-dicarboxyli...)
Show SMILES OC(=O)c1cnc2c(ccc3ncc(C(O)=O)c(O)c23)c1O
Show InChI InChI=1S/C14H8N2O6/c17-11-5-1-2-8-9(10(5)16-4-6(11)13(19)20)12(18)7(3-15-8)14(21)22/h1-4H,(H,15,18)(H,16,17)(H,19,20)(H,21,22)
PDB
MMDB

UniProtKB/TrEMBL

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

Patents


Similars

Article
PubMed
n/an/a 6.10E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against strand transfer of HIV-1 integrase in experiment 2


J Med Chem 40: 942-51 (1997)


Article DOI: 10.1021/jm960759e
BindingDB Entry DOI: 10.7270/Q2NK3FPV
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 integrase


(Human immunodeficiency virus 1)
BDBM50056926
PNG
(4,10-Dihydroxy-[1,7]phenanthroline-3,9-dicarboxyli...)
Show SMILES OC(=O)c1cnc2c(ccc3ncc(C(O)=O)c(O)c23)c1O
Show InChI InChI=1S/C14H8N2O6/c17-11-5-1-2-8-9(10(5)16-4-6(11)13(19)20)12(18)7(3-15-8)14(21)22/h1-4H,(H,15,18)(H,16,17)(H,19,20)(H,21,22)
PDB
MMDB

UniProtKB/TrEMBL

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

Patents


Similars

Article
PubMed
n/an/a 6.10E+3n/an/an/an/an/an/a



University of Houston

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 integrase


Bioorg Med Chem Lett 14: 1447-54 (2004)


Article DOI: 10.1016/j.bmcl.2004.01.027
BindingDB Entry DOI: 10.7270/Q2B858PN
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 integrase


(Human immunodeficiency virus 1)
BDBM50056926
PNG
(4,10-Dihydroxy-[1,7]phenanthroline-3,9-dicarboxyli...)
Show SMILES OC(=O)c1cnc2c(ccc3ncc(C(O)=O)c(O)c23)c1O
Show InChI InChI=1S/C14H8N2O6/c17-11-5-1-2-8-9(10(5)16-4-6(11)13(19)20)12(18)7(3-15-8)14(21)22/h1-4H,(H,15,18)(H,16,17)(H,19,20)(H,21,22)
PDB
MMDB

UniProtKB/TrEMBL

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

Patents


Similars

Article
PubMed
n/an/a 9.80E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration of compound against strand transfer of HIV-1 integrase in experiment 1


J Med Chem 40: 942-51 (1997)


Article DOI: 10.1021/jm960759e
BindingDB Entry DOI: 10.7270/Q2NK3FPV
More data for this
Ligand-Target Pair