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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Peptide deformylase' and Ligand = 'BDBM50137317'   
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
Peptide deformylase


(Escherichia coli)
BDBM50137317
PNG
((R)-2-Cyclopentylmethyl-N-[(S)-2,2-dimethyl-1-(4-m...)
Show SMILES CC(C)(C)[C@H](NC(=O)[C@H](CC1CCCC1)CN(O)C=O)C(=O)c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C26H39N3O5/c1-26(2,3)24(23(31)20-8-10-22(11-9-20)28-12-14-34-15-13-28)27-25(32)21(17-29(33)18-30)16-19-6-4-5-7-19/h8-11,18-19,21,24,33H,4-7,12-17H2,1-3H3,(H,27,32)/t21-,24-/m1/s1
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 6n/an/an/an/an/an/a



British Biotech Pharmaceuticals Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against Escherichia coli peptide deformylase (PDF) Nickel containing enzyme


Bioorg Med Chem Lett 14: 59-62 (2003)


BindingDB Entry DOI: 10.7270/Q2T43SHT
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50137317
PNG
((R)-2-Cyclopentylmethyl-N-[(S)-2,2-dimethyl-1-(4-m...)
Show SMILES CC(C)(C)[C@H](NC(=O)[C@H](CC1CCCC1)CN(O)C=O)C(=O)c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C26H39N3O5/c1-26(2,3)24(23(31)20-8-10-22(11-9-20)28-12-14-34-15-13-28)27-25(32)21(17-29(33)18-30)16-19-6-4-5-7-19/h8-11,18-19,21,24,33H,4-7,12-17H2,1-3H3,(H,27,32)/t21-,24-/m1/s1
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 6n/an/an/an/an/an/a



British Biotech Pharmaceuticals Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against Escherichia coli peptide deformylase (PDF) Nickel containing enzyme


Bioorg Med Chem Lett 14: 59-62 (2003)


BindingDB Entry DOI: 10.7270/Q2T43SHT
More data for this
Ligand-Target Pair