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SMILES: CCCCCC12CCC(CC1)(CC2)C(=O)Nc1cccc(c1)C(=O)CC(=O)C(O)=O

InChI Key: InChIKey=VEMFXTMKKXRIAR-UHFFFAOYSA-N

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 = 50479068   
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)
BDBM50479068
PNG
(CHEMBL511423)
Show SMILES CCCCCC12CCC(CC1)(CC2)C(=O)Nc1cccc(c1)C(=O)CC(=O)C(O)=O
Show InChI InChI=1S/C24H31NO5/c1-2-3-4-8-23-9-12-24(13-10-23,14-11-23)22(30)25-18-7-5-6-17(15-18)19(26)16-20(27)21(28)29/h5-7,15H,2-4,8-14,16H2,1H3,(H,25,30)(H,28,29)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of wild-type HIV1 integrase 3'-processing activity using [32P]-labeled linear oligonucleotide substrate by polyacrylamide gel electrophore...


Bioorg Med Chem 16: 7777-87 (2008)


Article DOI: 10.1016/j.bmc.2008.07.008
BindingDB Entry DOI: 10.7270/Q2M90CG4
More data for this
Ligand-Target Pair
Integrase


(Human immunodeficiency virus 1)
BDBM50479068
PNG
(CHEMBL511423)
Show SMILES CCCCCC12CCC(CC1)(CC2)C(=O)Nc1cccc(c1)C(=O)CC(=O)C(O)=O
Show InChI InChI=1S/C24H31NO5/c1-2-3-4-8-23-9-12-24(13-10-23,14-11-23)22(30)25-18-7-5-6-17(15-18)19(26)16-20(27)21(28)29/h5-7,15H,2-4,8-14,16H2,1H3,(H,25,30)(H,28,29)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.40E+4n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of wild-type HIV1 integrase strand transfer activity using [32P]-labeled linear oligonucleotide substrate by polyacrylamide gel electropho...


Bioorg Med Chem 16: 7777-87 (2008)


Article DOI: 10.1016/j.bmc.2008.07.008
BindingDB Entry DOI: 10.7270/Q2M90CG4
More data for this
Ligand-Target Pair