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BDBM42412 (4E)-3-hydroxy-4-[4-(3-methoxyphenoxy)-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,5-dienone::(4E)-3-hydroxy-4-[4-(3-methoxyphenoxy)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,5-dien-1-one::(4E)-3-hydroxy-4-[4-(3-methoxyphenoxy)-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one::(4E)-4-[4-(3-methoxyphenoxy)-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one::MLS000083067::SMR000044893::cid_5389780

SMILES: COc1cccc(Oc2c[nH]nc2-c2ccc(O)cc2O)c1

InChI Key: InChIKey=ILZQDBWJWMOSJD-UHFFFAOYSA-N

Data: 2 IC50

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 = 42412   
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
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM42412
PNG
((4E)-3-hydroxy-4-[4-(3-methoxyphenoxy)-1,2-dihydro...)
Show SMILES COc1cccc(Oc2c[nH]nc2-c2ccc(O)cc2O)c1
Show InChI InChI=1S/C16H14N2O4/c1-21-11-3-2-4-12(8-11)22-15-9-17-18-16(15)13-6-5-10(19)7-14(13)20/h2-9,19-20H,1H3,(H,17,18)
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PC cid
PC sid
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Similars

PCBioAssay
n/an/a>3.50E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


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


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2V1235Z
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM42412
PNG
((4E)-3-hydroxy-4-[4-(3-methoxyphenoxy)-1,2-dihydro...)
Show SMILES COc1cccc(Oc2c[nH]nc2-c2ccc(O)cc2O)c1
Show InChI InChI=1S/C16H14N2O4/c1-21-11-3-2-4-12(8-11)22-15-9-17-18-16(15)13-6-5-10(19)7-14(13)20/h2-9,19-20H,1H3,(H,17,18)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a<3.50E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


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


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2ZS2TWK
More data for this
Ligand-Target Pair