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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'PA-I galactophilic lectin' and Ligand = 'BDBM50598576'   
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
PA-I galactophilic lectin


(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
BDBM50598576
PNG
(CHEMBL3590184)
Show SMILES OC[C@H]1O[C@@H](Sc2ccc3ccccc3c2)[C@H](O)[C@@H](O)[C@H]1O |r|
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
n/an/an/a 6.30E+3n/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
PA-I galactophilic lectin


(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
BDBM50598576
PNG
(CHEMBL3590184)
Show SMILES OC[C@H]1O[C@@H](Sc2ccc3ccccc3c2)[C@H](O)[C@@H](O)[C@H]1O |r|
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/an/a 6.30E+3n/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01039
BindingDB Entry DOI: 10.7270/Q2NS0ZZK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)