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BDBM45941 (5-m-anisyl-1-phenyl-1,2,4-triazol-3-yl)amine::5-[(3-methoxyphenyl)methyl]-1-phenyl-1,2,4-triazol-3-amine::MLS-0146176.0001::cid_24178150

SMILES: COc1cccc(Cc2nc(N)nn2-c2ccccc2)c1

InChI Key: InChIKey=PJRPJSIJURRHBC-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 = 45941   
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 (Human))
BDBM45941
PNG
((5-m-anisyl-1-phenyl-1,2,4-triazol-3-yl)amine | 5-...)
Show SMILES COc1cccc(Cc2nc(N)nn2-c2ccccc2)c1
Show InChI InChI=1S/C16H16N4O/c1-21-14-9-5-6-12(10-14)11-15-18-16(17)19-20(15)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H2,17,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>1.00E+5n/an/an/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 (SBMRI, San Diego, C...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29S1PG8
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM45941
PNG
((5-m-anisyl-1-phenyl-1,2,4-triazol-3-yl)amine | 5-...)
Show SMILES COc1cccc(Cc2nc(N)nn2-c2ccccc2)c1
Show InChI InChI=1S/C16H16N4O/c1-21-14-9-5-6-12(10-14)11-15-18-16(17)19-20(15)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H2,17,19)
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>1.00E+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 (2010)


BindingDB Entry DOI: 10.7270/Q2CR5RRG
More data for this
Ligand-Target Pair