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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for monomerid = 93498   
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
COUP transcription factor 2


(Homo sapiens (Human))
BDBM93498
PNG
(4-[2-(3,5-dimethyl-5-oxidanyl-2-oxidanylidene-cycl...)
Show SMILES CC1CC(C)(O)CC(C(O)CC2CC(=O)NC(=O)C2)C1=O
Show InChI InChI=1S/C15H23NO5/c1-8-6-15(2,21)7-10(14(8)20)11(17)3-9-4-12(18)16-13(19)5-9/h8-11,17,21H,3-7H2,1-2H3,(H,16,18,19)
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KEGG

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n/an/a 360n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q21Z431S
More data for this
Ligand-Target Pair
Beta-lactamase


(Pseudomonas aeruginosa)
BDBM93498
PNG
(4-[2-(3,5-dimethyl-5-oxidanyl-2-oxidanylidene-cycl...)
Show SMILES CC1CC(C)(O)CC(C(O)CC2CC(=O)NC(=O)C2)C1=O
Show InChI InChI=1S/C15H23NO5/c1-8-6-15(2,21)7-10(14(8)20)11(17)3-9-4-12(18)16-13(19)5-9/h8-11,17,21H,3-7H2,1-2H3,(H,16,18,19)
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n/an/a>4.97E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2XS5T0R
More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM93498
PNG
(4-[2-(3,5-dimethyl-5-oxidanyl-2-oxidanylidene-cycl...)
Show SMILES CC1CC(C)(O)CC(C(O)CC2CC(=O)NC(=O)C2)C1=O
Show InChI InChI=1S/C15H23NO5/c1-8-6-15(2,21)7-10(14(8)20)11(17)3-9-4-12(18)16-13(19)5-9/h8-11,17,21H,3-7H2,1-2H3,(H,16,18,19)
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UniProtKB/SwissProt

antibodypedia
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UniChem

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PCBioAssay
n/an/a>4.97E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2T15278
More data for this
Ligand-Target Pair
Tegument protein VP16


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM93498
PNG
(4-[2-(3,5-dimethyl-5-oxidanyl-2-oxidanylidene-cycl...)
Show SMILES CC1CC(C)(O)CC(C(O)CC2CC(=O)NC(=O)C2)C1=O
Show InChI InChI=1S/C15H23NO5/c1-8-6-15(2,21)7-10(14(8)20)11(17)3-9-4-12(18)16-13(19)5-9/h8-11,17,21H,3-7H2,1-2H3,(H,16,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a 8.53E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2GM85ZT
More data for this
Ligand-Target Pair