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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for monomerid = 76166   
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
Intestinal-type alkaline phosphatase 1


(Rattus norvegicus (Rat))
BDBM76166
PNG
(1-(m-tolyl)-3-(9-p-anisyl-9-azabicyclo[3.3.1]nonan...)
Show SMILES [H]C12CCCC([H])(CC(C1)NC(=O)Nc1cccc(C)c1)N2Cc1ccc(OC)cc1
Show InChI InChI=1S/C24H31N3O2/c1-17-5-3-6-19(13-17)25-24(28)26-20-14-21-7-4-8-22(15-20)27(21)16-18-9-11-23(29-2)12-10-18/h3,5-6,9-13,20-22H,4,7-8,14-16H2,1-2H3,(H2,25,26,28)
PDB

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.10E+4n/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 (2010)


BindingDB Entry DOI: 10.7270/Q2DB809V
More data for this
Ligand-Target Pair
Intestinal-type alkaline phosphatase


(Homo sapiens (Human))
BDBM76166
PNG
(1-(m-tolyl)-3-(9-p-anisyl-9-azabicyclo[3.3.1]nonan...)
Show SMILES [H]C12CCCC([H])(CC(C1)NC(=O)Nc1cccc(C)c1)N2Cc1ccc(OC)cc1
Show InChI InChI=1S/C24H31N3O2/c1-17-5-3-6-19(13-17)25-24(28)26-20-14-21-7-4-8-22(15-20)27(21)16-18-9-11-23(29-2)12-10-18/h3,5-6,9-13,20-22H,4,7-8,14-16H2,1-2H3,(H2,25,26,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.27E+4n/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, CA...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2X63KDM
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM76166
PNG
(1-(m-tolyl)-3-(9-p-anisyl-9-azabicyclo[3.3.1]nonan...)
Show SMILES [H]C12CCCC([H])(CC(C1)NC(=O)Nc1cccc(C)c1)N2Cc1ccc(OC)cc1
Show InChI InChI=1S/C24H31N3O2/c1-17-5-3-6-19(13-17)25-24(28)26-20-14-21-7-4-8-22(15-20)27(21)16-18-9-11-23(29-2)12-10-18/h3,5-6,9-13,20-22H,4,7-8,14-16H2,1-2H3,(H2,25,26,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.05E+4n/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 (2010)


BindingDB Entry DOI: 10.7270/Q2NS0SCW
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM76166
PNG
(1-(m-tolyl)-3-(9-p-anisyl-9-azabicyclo[3.3.1]nonan...)
Show SMILES [H]C12CCCC([H])(CC(C1)NC(=O)Nc1cccc(C)c1)N2Cc1ccc(OC)cc1
Show InChI InChI=1S/C24H31N3O2/c1-17-5-3-6-19(13-17)25-24(28)26-20-14-21-7-4-8-22(15-20)27(21)16-18-9-11-23(29-2)12-10-18/h3,5-6,9-13,20-22H,4,7-8,14-16H2,1-2H3,(H2,25,26,28)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.22E+4n/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 (2010)


BindingDB Entry DOI: 10.7270/Q2H130G1
More data for this
Ligand-Target Pair