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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Polyadenylate-binding protein 1' and Ligand = 'BDBM37775'   
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
Polyadenylate-binding protein 1


(Homo sapiens (Human))
BDBM37775
PNG
(MLS000097330 | N-[5-(8-methoxy-4,4,6-trimethyl-2-o...)
Show SMILES COc1cc2\C(C(=O)N3c2c(c1)C(C)=CC3(C)C)=C1\SC(NC(C)=O)=NC1=O |c:15,27|
Show InChI InChI=1S/C20H19N3O4S/c1-9-8-20(3,4)23-15-12(9)6-11(27-5)7-13(15)14(18(23)26)16-17(25)22-19(28-16)21-10(2)24/h6-8H,1-5H3,(H,21,22,24,25)/b16-14-
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a>6.60E+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 (2012)


BindingDB Entry DOI: 10.7270/Q2V40ST1
More data for this
Ligand-Target Pair
Polyadenylate-binding protein 1


(Homo sapiens (Human))
BDBM37775
PNG
(MLS000097330 | N-[5-(8-methoxy-4,4,6-trimethyl-2-o...)
Show SMILES COc1cc2\C(C(=O)N3c2c(c1)C(C)=CC3(C)C)=C1\SC(NC(C)=O)=NC1=O |c:15,27|
Show InChI InChI=1S/C20H19N3O4S/c1-9-8-20(3,4)23-15-12(9)6-11(27-5)7-13(15)14(18(23)26)16-17(25)22-19(28-16)21-10(2)24/h6-8H,1-5H3,(H,21,22,24,25)/b16-14-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>6.60E+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 (2012)


BindingDB Entry DOI: 10.7270/Q2ZW1JJF
More data for this
Ligand-Target Pair