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Compile Data Set for Download or QSAR

Found 3 hits of kon for UniProtKB: P06276   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cholinesterase


(Homo sapiens (Human))
BDBM50235799
PNG
(CHEMBL4096024)
Show SMILES Cl.CCC(C)(C)NCC(O)c1cc(OC(=O)N(C)C)cc(OC(=O)N(C)C)c1
Show InChI InChI=1S/C19H31N3O5.ClH/c1-8-19(2,3)20-12-16(23)13-9-14(26-17(24)21(4)5)11-15(10-13)27-18(25)22(6)7;/h9-11,16,20,23H,8,12H2,1-7H3;1H
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PC cid
PC sid
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Article
PubMed
n/an/an/an/an/an/a 1.00E+5n/an/a



South China University of Technology

Curated by ChEMBL


Assay Description
Irreversible inhibition of human plasma BuChE assessed as second order carbamylation rate constant using S-butyrylthiocholine iodide as substrate pre...


Eur J Med Chem 126: 61-71 (2017)


Article DOI: 10.1016/j.ejmech.2016.08.061
BindingDB Entry DOI: 10.7270/Q2571F8X
More data for this
Ligand-Target Pair
Cholinesterase


(Homo sapiens (Human))
BDBM50235801
PNG
(CHEMBL4098455)
Show SMILES Cl.CCN(C)C(=O)Oc1cc(OC(=O)N(C)CC)cc(c1)C(O)CNC(C)(C)CC
Show InChI InChI=1S/C21H35N3O5.ClH/c1-8-21(4,5)22-14-18(25)15-11-16(28-19(26)23(6)9-2)13-17(12-15)29-20(27)24(7)10-3;/h11-13,18,22,25H,8-10,14H2,1-7H3;1H
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Similars

Article
PubMed
n/an/an/an/an/an/a 1.22E+5n/an/a



South China University of Technology

Curated by ChEMBL


Assay Description
Tested for the ability to compete with [125I]-CO13 ([125I]-Y-F-K-A-Cha-G-L-dF-R) for binding to C5a anaphylatoxin chemotactic receptor from human neu...


Eur J Med Chem 126: 61-71 (2017)


Article DOI: 10.1016/j.ejmech.2016.08.061
BindingDB Entry DOI: 10.7270/Q2571F8X
More data for this
Ligand-Target Pair
Cholinesterase


(Homo sapiens (Human))
BDBM50235800
PNG
(Bambuterol | CHEBI:553827)
Show SMILES CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC(C)(C)C
Show InChI InChI=1S/C18H29N3O5/c1-18(2,3)19-11-15(22)12-8-13(25-16(23)20(4)5)10-14(9-12)26-17(24)21(6)7/h8-10,15,19,22H,11H2,1-7H3
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MCE
PC cid
PC sid
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Article
PubMed
n/an/an/an/an/an/a 1.30E+5n/an/a



South China University of Technology

Curated by ChEMBL


Assay Description
Antagonism of batrachotoxin-mediated sodium ion uptake into cultured neuroblastoma cells


Eur J Med Chem 126: 61-71 (2017)


Article DOI: 10.1016/j.ejmech.2016.08.061
BindingDB Entry DOI: 10.7270/Q2571F8X
More data for this
Ligand-Target Pair