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Compile Data Set for Download or QSAR

Found 5 hits with Last Name = 'abriel' and Initial = 'h'   
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
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50350791
PNG
(LEVOBUPIVACAINE HYDROCHLORIDE)
Show SMILES CCCCN1CCCC[C@H]1C(=O)Nc1c(C)cccc1C
Show InChI InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)/t16-/m0/s1
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KEGG
PC cid
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Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



University of Geneva

Curated by ChEMBL


Assay Description
Inhibition of wild-type human ERG channel expressed in HEK293 cells assessed as blockade of potassium tail current by whole-cell patch clamp techniqu...


Eur J Med Chem 46: 3486-98 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.015
BindingDB Entry DOI: 10.7270/Q2TD9XQ6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50350791
PNG
(LEVOBUPIVACAINE HYDROCHLORIDE)
Show SMILES CCCCN1CCCC[C@H]1C(=O)Nc1c(C)cccc1C
Show InChI InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)/t16-/m0/s1
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Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



University of Geneva

Curated by ChEMBL


Assay Description
Inhibition of wild-type human ERG channel expressed in CHO cells by whole-cell patch clamp technique


Eur J Med Chem 46: 3486-98 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.015
BindingDB Entry DOI: 10.7270/Q2TD9XQ6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50350790
PNG
(BUPIVACAINE HYDROCHLORIDE | Bupivacaine | SAMPL3, ...)
Show SMILES CCCCN1CCCCC1C(=O)Nc1c(C)cccc1C
Show InChI InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)
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Article
PubMed
n/an/a 2.20E+4n/an/an/an/an/an/a



University of Geneva

Curated by ChEMBL


Assay Description
Inhibition of wild-type human ERG channel expressed in CHO cells by whole-cell patch clamp technique


Eur J Med Chem 46: 3486-98 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.015
BindingDB Entry DOI: 10.7270/Q2TD9XQ6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50350790
PNG
(BUPIVACAINE HYDROCHLORIDE | Bupivacaine | SAMPL3, ...)
Show SMILES CCCCN1CCCCC1C(=O)Nc1c(C)cccc1C
Show InChI InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)
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Article
PubMed
n/an/a 3.20E+4n/an/an/an/an/an/a



University of Geneva

Curated by ChEMBL


Assay Description
Inhibition of wild-type human ERG channel expressed in HEK293 cells assessed as blockade of potassium tail current by whole-cell patch clamp techniqu...


Eur J Med Chem 46: 3486-98 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.015
BindingDB Entry DOI: 10.7270/Q2TD9XQ6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50350789
PNG
(BUPIVACAINE | CHEMBL189827)
Show SMILES CCCCN1CCCC[C@@H]1C(=O)Nc1c(C)cccc1C
Show InChI InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)/t16-/m1/s1
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CHEMBL
PC cid
PC sid
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Article
PubMed
n/an/a 8.40E+4n/an/an/an/an/an/a



University of Geneva

Curated by ChEMBL


Assay Description
Inhibition of wild-type human ERG channel expressed in HEK293 cells assessed as blockade of potassium tail current by whole-cell patch clamp techniqu...


Eur J Med Chem 46: 3486-98 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.015
BindingDB Entry DOI: 10.7270/Q2TD9XQ6
More data for this
Ligand-Target Pair