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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitochondrial peptide methionine sulfoxide reductase' and Ligand = 'BDBM91490'   
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
Mitochondrial peptide methionine sulfoxide reductase


(Bos taurus)
BDBM91490
PNG
(1-(8-methyl-1,3,4,5-tetrahydropyrid[4,3-b]indol-2-...)
Show SMILES Cc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C23H27N5O/c1-17-5-6-20-18(14-17)19-15-28(9-7-21(19)25-20)23(29)16-26-10-12-27(13-11-26)22-4-2-3-8-24-22/h2-6,8,14,25H,7,9-13,15-16H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>1.04E+5n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2BZ64NT
More data for this
Ligand-Target Pair