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BDBM39679 (Z)-[2-keto-3-(p-tolyl)-5-pyridin-1-ium-1-yl-3-imidazolin-4-ylidene]methanolate::(Z)-[3-(4-methylphenyl)-2-oxidanylidene-5-pyridin-1-ium-1-yl-imidazol-4-ylidene]methanolate::(Z)-[3-(4-methylphenyl)-2-oxo-5-(1-pyridin-1-iumyl)-4-imidazolylidene]methanolate::(Z)-[3-(4-methylphenyl)-2-oxo-5-pyridin-1-ium-1-ylimidazol-4-ylidene]methanolate::MLS000518917::SMR000129337::cid_6096357

SMILES: Cc1ccc(cc1)-n1c(C=O)c([n-]c1=O)-[n+]1ccccc1

InChI Key: InChIKey=YJQTZMCQCQZVAR-UHFFFAOYSA-N

Data: 1 IC50  1 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 = 39679   
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
Alkaline phosphatase placental-like


(Homo sapiens)
BDBM39679
PNG
((Z)-[2-keto-3-(p-tolyl)-5-pyridin-1-ium-1-yl-3-imi...)
Show SMILES Cc1ccc(cc1)-n1c(C=O)c([n-]c1=O)-[n+]1ccccc1
Show InChI InChI=1S/C16H13N3O2/c1-12-5-7-13(8-6-12)19-14(11-20)15(17-16(19)21)18-9-3-2-4-10-18/h2-11H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/an/an/a 9.08E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens)
BDBM39679
PNG
((Z)-[2-keto-3-(p-tolyl)-5-pyridin-1-ium-1-yl-3-imi...)
Show SMILES Cc1ccc(cc1)-n1c(C=O)c([n-]c1=O)-[n+]1ccccc1
Show InChI InChI=1S/C16H13N3O2/c1-12-5-7-13(8-6-12)19-14(11-20)15(17-16(19)21)18-9-3-2-4-10-18/h2-11H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 9.99E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2MS3R5M
More data for this
Ligand-Target Pair