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Compile Data Set for Download or QSAR

Found 3 hits of kon data for polymerid = 50002853,5393,50002853,5393   
Target
(Institution)
LigandTarget
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
3-dehydroquinate synthase


(Escherichia coli (strain K12))
BDBM50028883
PNG
((1S,3S,5R)-1,3-Dihydroxy-5-phosphonomethyl-cyclohe...)
Show SMILES O[C@H]1C[C@@H](CP(O)(O)=O)C[C@](O)(C1)C(O)=O
Show InChI InChI=1S/C8H15O7P/c9-6-1-5(4-16(13,14)15)2-8(12,3-6)7(10)11/h5-6,9,12H,1-4H2,(H,10,11)(H2,13,14,15)/t5-,6+,8+/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/an/an/an/a 0.000540 1.00E+3n/an/a



TBA

Curated by ChEMBL


Assay Description
Association rate constant of the compound was determined against 3-dehydroquinate synthase


Citation and Details
More data for this
Ligand-Target Pair
3-dehydroquinate synthase


(Escherichia coli (strain K12))
BDBM50028881
PNG
((1R,3S,4S)-1,4-Dihydroxy-3-phosphonomethyl-cyclohe...)
Show SMILES O[C@H]1CC[C@@](O)(C[C@@H]1CP(O)(O)=O)C(O)=O
Show InChI InChI=1S/C8H15O7P/c9-6-1-2-8(12,7(10)11)3-5(6)4-16(13,14)15/h5-6,9,12H,1-4H2,(H,10,11)(H2,13,14,15)/t5-,6+,8-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/an/an/an/a 0.000320 1.50E+3n/an/a



TBA

Curated by ChEMBL


Assay Description
Association rate constant of the compound was determined against 3-dehydroquinate synthase


Citation and Details
More data for this
Ligand-Target Pair
3-dehydroquinate synthase


(Escherichia coli (strain K12))
BDBM50280172
PNG
(1,3,4-Trihydroxy-5-phosphonomethyl-cyclohexanecarb...)
Show SMILES OC1CC(O)(CC(CP(O)(O)=O)C1O)C(O)=O
Show InChI InChI=1S/C8H15O8P/c9-5-2-8(13,7(11)12)1-4(6(5)10)3-17(14,15)16/h4-6,9-10,13H,1-3H2,(H,11,12)(H2,14,15,16)
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem

Similars

AffyNet 
Article
n/an/an/an/an/a 0.000750 1.40E+5n/an/a



TBA

Curated by ChEMBL


Assay Description
Association rate constant of the compound was determined against 3-dehydroquinate synthase


Citation and Details
More data for this
Ligand-Target Pair