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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Galactokinase' and Ligand = 'BDBM50588170'   
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
Galactokinase


(Homo sapiens (Human))
BDBM50588170
PNG
(CHEMBL5088290)
Show SMILES CC1=C(C(N=C(Nc2nc3ccc(F)c(N)c3o2)N1)c1ccc(C)cc1Cl)C(=O)NCc1cnn(C)c1 |t:1,4|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 48n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00945
BindingDB Entry DOI: 10.7270/Q2Z323MD
More data for this
Ligand-Target Pair
Galactokinase


(Homo sapiens (Human))
BDBM50588170
PNG
(CHEMBL5088290)
Show SMILES CC1=C(C(N=C(Nc2nc3ccc(F)c(N)c3o2)N1)c1ccc(C)cc1Cl)C(=O)NCc1cnn(C)c1 |t:1,4|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 50n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00945
BindingDB Entry DOI: 10.7270/Q2Z323MD
More data for this
Ligand-Target Pair
Galactokinase


(Mus musculus)
BDBM50588170
PNG
(CHEMBL5088290)
Show SMILES CC1=C(C(N=C(Nc2nc3ccc(F)c(N)c3o2)N1)c1ccc(C)cc1Cl)C(=O)NCc1cnn(C)c1 |t:1,4|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 690n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00945
BindingDB Entry DOI: 10.7270/Q2Z323MD
More data for this
Ligand-Target Pair