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BDBM83999 MLS000554836::SMR000146953::Sodium; (2Z,4Z)-3-methyl-5-pyridin-3-yl-penta-2,4-dienoate::cid_23681232::sodium;(2Z,4Z)-3-methyl-5-(3-pyridinyl)penta-2,4-dienoate::sodium;(2Z,4Z)-3-methyl-5-(3-pyridyl)penta-2,4-dienoate::sodium;(2Z,4Z)-3-methyl-5-pyridin-3-yl-penta-2,4-dienoate::sodium;(2Z,4Z)-3-methyl-5-pyridin-3-ylpenta-2,4-dienoate

SMILES: C\C(\C=C/c1cccnc1)=C\C([O-])=O

InChI Key: InChIKey=RFGMDOCXGCLNGA-PHSHQRSZSA-M

Data: 2 EC50

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 = 83999   
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
Apoptotic peptidase activating factor 1


(Homo sapiens (Human))
BDBM83999
PNG
(MLS000554836 | SMR000146953 | Sodium; (2Z,4Z)-3-me...)
Show SMILES C\C(\C=C/c1cccnc1)=C\C([O-])=O
Show InChI InChI=1S/C11H11NO2/c1-9(7-11(13)14)4-5-10-3-2-6-12-8-10/h2-8H,1H3,(H,13,14)/p-1/b5-4-,9-7-
PDB
MMDB

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KEGG

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 1.10E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q29C6VXX
More data for this
Ligand-Target Pair
Apoptotic peptidase activating factor 1


(Homo sapiens (Human))
BDBM83999
PNG
(MLS000554836 | SMR000146953 | Sodium; (2Z,4Z)-3-me...)
Show SMILES C\C(\C=C/c1cccnc1)=C\C([O-])=O
Show InChI InChI=1S/C11H11NO2/c1-9(7-11(13)14)4-5-10-3-2-6-12-8-10/h2-8H,1H3,(H,13,14)/p-1/b5-4-,9-7-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.00E+5n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2SB447H
More data for this
Ligand-Target Pair