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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50409838   
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)
BDBM50409838
PNG
(CHEMBL127330)
Show SMILES Sc1cc(Cl)c(cc1S(=O)(=O)Nc1nncn1-c1ccc(Cl)cc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C21H15Cl2N5O3S2/c22-13-6-8-15(9-7-13)28-12-24-26-21(28)27-33(30,31)19-10-16(17(23)11-18(19)32)20(29)25-14-4-2-1-3-5-14/h1-12,32H,(H,25,29)(H,26,27)
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 6.03E+3n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibitory activity against 3' processing by HIV integrase


J Med Chem 47: 385-99 (2004)


Article DOI: 10.1021/jm030378i
BindingDB Entry DOI: 10.7270/Q2M61MFX
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50409838
PNG
(CHEMBL127330)
Show SMILES Sc1cc(Cl)c(cc1S(=O)(=O)Nc1nncn1-c1ccc(Cl)cc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C21H15Cl2N5O3S2/c22-13-6-8-15(9-7-13)28-12-24-26-21(28)27-33(30,31)19-10-16(17(23)11-18(19)32)20(29)25-14-4-2-1-3-5-14/h1-12,32H,(H,25,29)(H,26,27)
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibitory activity against DNA strand transfer by HIV integrase


J Med Chem 47: 385-99 (2004)


Article DOI: 10.1021/jm030378i
BindingDB Entry DOI: 10.7270/Q2M61MFX
More data for this
Ligand-Target Pair