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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Apoptotic protease-activating factor 1' and Ligand = 'BDBM53185'   
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
Apoptotic protease-activating factor 1


(Homo sapiens (Human))
BDBM53185
PNG
(2-(trifluoromethyl)-1H-perimidine-4-carbaldehyde |...)
Show SMILES FC(F)(F)c1nc2cccc3ccc(C=O)c([nH]1)c23
Show InChI InChI=1S/C13H7F3N2O/c14-13(15,16)12-17-9-3-1-2-7-4-5-8(6-19)11(18-12)10(7)9/h1-6H,(H,17,18)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 9.20E+3n/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 (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2JS9NZB
More data for this
Ligand-Target Pair
Apoptotic protease-activating factor 1


(Homo sapiens (Human))
BDBM53185
PNG
(2-(trifluoromethyl)-1H-perimidine-4-carbaldehyde |...)
Show SMILES FC(F)(F)c1nc2cccc3ccc(C=O)c([nH]1)c23
Show InChI InChI=1S/C13H7F3N2O/c14-13(15,16)12-17-9-3-1-2-7-4-5-8(6-19)11(18-12)10(7)9/h1-6H,(H,17,18)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.04E+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 (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2F18X8S
More data for this
Ligand-Target Pair