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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Integrase' AND taxid = 11703   
Target
(Institution)
LigandTarget
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 type 1 (HIV-1))
BDBM151087
PNG
(US8987272, COTI-HIV28236)
Show SMILES Cn1[nH]c(C(=O)NCc2ccc(F)cc2)\c(=N\O)c2ncccc12
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
AffyNet 
US Patent
n/an/a 1.40E+4n/an/an/an/an/an/a



Critical Outcome Technologies Inc.

US Patent


Assay Description
The effect of each compound on HIV integrase activity was assayed using the HIV-1 Integrase Assay Kit version 2.0, catalogue number EZ-1700 obtained ...


US Patent US8987272 (2015)

More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus type 1 (HIV-1))
BDBM151089
PNG
(US8987272, COTI-HIV28233)
Show SMILES Cn1nc(-c2nnc(Cc3ccc(F)cc3)o2)\c(=N\O)c2ncccc12
Show InChI InChI=1S/C17H13FN6O2/c1-24-12-3-2-8-19-14(12)15(23-25)16(22-24)17-21-20-13(26-17)9-10-4-6-11(18)7-5-10/h2-8,25H,9H2,1H3/b23-15+
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
AffyNet 
US Patent
n/an/a 2.39E+4n/an/an/an/an/an/a



Critical Outcome Technologies Inc.

US Patent


Assay Description
The effect of each compound on HIV integrase activity was assayed using the HIV-1 Integrase Assay Kit version 2.0, catalogue number EZ-1700 obtained ...


US Patent US8987272 (2015)

More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus type 1 (HIV-1))
BDBM151088
PNG
(US8987272, COTI-HIV-1)
Show SMILES Cn1cnc(-c2nnc(Cc3ccc(F)cc3)o2)c(O)\c1=N\O
Show InChI InChI=1S/C14H12FN5O3/c1-20-7-16-11(12(21)13(20)19-22)14-18-17-10(23-14)6-8-2-4-9(15)5-3-8/h2-5,7,21-22H,6H2,1H3/b19-13-
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
AffyNet 
US Patent
n/an/a 5.87E+4n/an/an/an/an/an/a



Critical Outcome Technologies Inc.

US Patent


Assay Description
The effect of each compound on HIV integrase activity was assayed using the HIV-1 Integrase Assay Kit version 2.0, catalogue number EZ-1700 obtained ...


US Patent US8987272 (2015)

More data for this
Ligand-Target Pair