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BDBM50170144 CHEMBL188293::{2-[(E)-2-(3,4-Dihydroxy-phenyl)-vinyl]-8-hydroxy-quinolin-7-yl}-pyridin-3-yl-methanone

SMILES: Oc1ccc(\C=C\c2ccc3ccc(C(=O)c4cccnc4)c(O)c3n2)cc1O

InChI Key: InChIKey=KOXMUIJVVUZLEA-XVNBXDOJSA-N

Data: 2 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 2 hits for monomerid = 50170144   
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 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50170144
PNG
(CHEMBL188293 | {2-[(E)-2-(3,4-Dihydroxy-phenyl)-vi...)
Show SMILES Oc1ccc(\C=C\c2ccc3ccc(C(=O)c4cccnc4)c(O)c3n2)cc1O
Show InChI InChI=1S/C23H16N2O4/c26-19-10-4-14(12-20(19)27)3-7-17-8-5-15-6-9-18(23(29)21(15)25-17)22(28)16-2-1-11-24-13-16/h1-13,26-27,29H/b7-3+
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Unité Associée au CNRS

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against HIV-1 recombinant integrase activity in standard 3'-processing assay


Bioorg Med Chem Lett 15: 4019-22 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.036
BindingDB Entry DOI: 10.7270/Q2GM86VW
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50170144
PNG
(CHEMBL188293 | {2-[(E)-2-(3,4-Dihydroxy-phenyl)-vi...)
Show SMILES Oc1ccc(\C=C\c2ccc3ccc(C(=O)c4cccnc4)c(O)c3n2)cc1O
Show InChI InChI=1S/C23H16N2O4/c26-19-10-4-14(12-20(19)27)3-7-17-8-5-15-6-9-18(23(29)21(15)25-17)22(28)16-2-1-11-24-13-16/h1-13,26-27,29H/b7-3+
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Unité Associée au CNRS

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against HIV-1 recombinant integrase activity in strand transfer assay


Bioorg Med Chem Lett 15: 4019-22 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.036
BindingDB Entry DOI: 10.7270/Q2GM86VW
More data for this
Ligand-Target Pair