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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Alkaline phosphatase, germ cell type' and Ligand = 'BDBM39591'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39591
PNG
(1-(3-benzyl-2-imino-benzimidazol-1-yl)-3-(4-methox...)
Show SMILES COc1ccc(OCC(O)Cn2c3ccccc3n(Cc3ccccc3)c2=N)cc1
Show InChI InChI=1S/C24H25N3O3/c1-29-20-11-13-21(14-12-20)30-17-19(28)16-27-23-10-6-5-9-22(23)26(24(27)25)15-18-7-3-2-4-8-18/h2-14,19,25,28H,15-17H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
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
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39591
PNG
(1-(3-benzyl-2-imino-benzimidazol-1-yl)-3-(4-methox...)
Show SMILES COc1ccc(OCC(O)Cn2c3ccccc3n(Cc3ccccc3)c2=N)cc1
Show InChI InChI=1S/C24H25N3O3/c1-29-20-11-13-21(14-12-20)30-17-19(28)16-27-23-10-6-5-9-22(23)26(24(27)25)15-18-7-3-2-4-8-18/h2-14,19,25,28H,15-17H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 9.99E+5n/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