null

SMILES CCCCc1c(O)n(-c2ccccc2)n(-c2ccccc2)c1=O

InChI Key InChIKey=PKYKNPLSFOKASK-UHFFFAOYSA-N

PDB links: 5 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 13 hits for monomerid = 50022309   

TargetfMet-Leu-Phe receptor(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataKi:  3.50E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2NZ862KPCBioAssay
TargetCytochrome P450 2C9(Homo sapiens (Human))
AstraZeneca R&D

Curated by ChEMBL
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataKi:  1.90E+4nMAssay Description:Binding affinity towards cytochrome P450 2C9More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2ZK5HF3PubMed
TargetSolute carrier family 22 member 8(Homo sapiens (Human))
Kyorin University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataKi:  3.47E+4nMAssay Description:TP_TRANSPORTER: inhibition of MTX uptake in OAT3-expressing S2 cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2HH6MBNPubMed
TargetN-formyl peptide receptor 2(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataKi: >4.03E+4nMAssay Description:University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2DF6PMFPCBioAssay
TargetProstaglandin G/H synthase 2(Canis familiaris)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataIC50: 3.79E+3nMAssay Description:Inhibitory activity of the compound against canine COX-2More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2J965NJPubMed
TargetProstaglandin G/H synthase 1/2(RAT)
TBA

Curated by ChEMBL
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataIC50: 1.50E+4nMAssay Description:Compound was tested for inhibition of prostaglandin synthetase when administered perorallyMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q28W3GHQPubMed
TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
DuPont Merck Pharmaceutical Company

Curated by ChEMBL
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataIC50: 2.84E+5nMAssay Description:Tested for inhibitory activity against Prostaglandin G/H synthase 2 from humanMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q28C9WX5PubMed
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
DuPont Merck Pharmaceutical Company

Curated by ChEMBL
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataIC50: 3.84E+5nMAssay Description:Tested for inhibitory activity against Prostaglandin G/H synthase 1 from ovineMore data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q28C9WX5PubMed
TargetIntegrin alpha-4(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataEC50:  1.06E+3nMAssay Description:Assay Support: 1 X01 MH077638-01 MLSCN Assay for Allosteric Ligands for the VLA-4 Integrin PI: SKLAR, LARRY A University of New Mexico Assay Overview...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2H130FKPCBioAssay
TargetEstrogen receptor(Homo sapiens (Human))
Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataIC50: 5.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2QJ7FQ3PCBioAssay
TargetN-formyl peptide receptor 2(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataIC50: 6.67E+4nMAssay Description:University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2DF6PMFPCBioAssay
TargetfMet-Leu-Phe receptor(Homo sapiens (Human))
NMMLSC

Curated by PubChem BioAssay
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataIC50: 5.30E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2J67FB5PCBioAssay
TargetProstaglandin G/H synthase 1(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50022309(3,5-Dioxo-1,2-diphenyl-4-n-butylpyrazolidine | 4-b...)copy SMILEScopy InChI
Affinity DataIC50: 3.00E+3nMAssay Description:Compound was evaluated for inhibition of Prostaglandin G/H synthase 1More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2BV7H40