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7 similar compounds to monomer 50348098

Compile data set for download or QSAR
Wt: 380.9
BDBM50348104
Wt: 366.9
BDBM50348106
Wt: 380.9
BDBM50348107
Wt: 416.9
BDBM50348108
Wt: 434.9
BDBM50348109
Wt: 443.0
BDBM50348110
Wt: 394.9
BDBM50348113

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50348104,50348106,50348107,50348108,50348109,50348110,50348113   
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
Amiloride-sensitive cation channel 3


(Homo sapiens)
BDBM50348104
PNG
(CHEMBL1800428)
Show SMILES CC1N(C)CCc2ccc(cc12)C#Cc1ccc2c(Cl)c(CN)sc2c1
Show InChI InChI=1S/C22H21ClN2S/c1-14-19-11-15(5-7-17(19)9-10-25(14)2)3-4-16-6-8-18-20(12-16)26-21(13-24)22(18)23/h5-8,11-12,14H,9-10,13,24H2,1-2H3
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n/an/a 270n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ASIC3 assessed as inhibition of peak current by electrophysiology method


Bioorg Med Chem Lett 21: 4255-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.064
BindingDB Entry DOI: 10.7270/Q2DZ08P8
More data for this
Ligand-Target Pair
Amiloride-sensitive cation channel 3


(Homo sapiens)
BDBM50348106
PNG
(CHEMBL1800431)
Show SMILES CN1CCc2ccc(cc2C1)C#Cc1ccc2c(Cl)c(CN)sc2c1
Show InChI InChI=1S/C21H19ClN2S/c1-24-9-8-16-6-4-14(10-17(16)13-24)2-3-15-5-7-18-19(11-15)25-20(12-23)21(18)22/h4-7,10-11H,8-9,12-13,23H2,1H3
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n/an/a 680n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ASIC3 assessed as inhibition of peak current by electrophysiology method


Bioorg Med Chem Lett 21: 4255-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.064
BindingDB Entry DOI: 10.7270/Q2DZ08P8
More data for this
Ligand-Target Pair
Amiloride-sensitive cation channel 3


(Homo sapiens)
BDBM50348107
PNG
(CHEMBL1800432)
Show SMILES CCN1CCc2ccc(cc2C1)C#Cc1ccc2c(Cl)c(CN)sc2c1
Show InChI InChI=1S/C22H21ClN2S/c1-2-25-10-9-17-7-5-15(11-18(17)14-25)3-4-16-6-8-19-20(12-16)26-21(13-24)22(19)23/h5-8,11-12H,2,9-10,13-14,24H2,1H3
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n/an/a 230n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ASIC3 assessed as inhibition of peak current by electrophysiology method


Bioorg Med Chem Lett 21: 4255-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.064
BindingDB Entry DOI: 10.7270/Q2DZ08P8
More data for this
Ligand-Target Pair
Amiloride-sensitive cation channel 3


(Homo sapiens)
BDBM50348113
PNG
(CHEMBL1800433)
Show SMILES CC(C)N1CCc2ccc(cc2C1)C#Cc1ccc2c(Cl)c(CN)sc2c1
Show InChI InChI=1S/C23H23ClN2S/c1-15(2)26-10-9-18-7-5-16(11-19(18)14-26)3-4-17-6-8-20-21(12-17)27-22(13-25)23(20)24/h5-8,11-12,15H,9-10,13-14,25H2,1-2H3
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n/an/a 310n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ASIC3 assessed as inhibition of peak current by electrophysiology method


Bioorg Med Chem Lett 21: 4255-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.064
BindingDB Entry DOI: 10.7270/Q2DZ08P8
More data for this
Ligand-Target Pair
Amiloride-sensitive cation channel 3


(Homo sapiens)
BDBM50348109
PNG
(CHEMBL1800435)
Show SMILES NCc1sc2cc(ccc2c1Cl)C#Cc1ccc2CCN(CC(F)(F)F)Cc2c1
Show InChI InChI=1S/C22H18ClF3N2S/c23-21-18-6-4-15(10-19(18)29-20(21)11-27)2-1-14-3-5-16-7-8-28(12-17(16)9-14)13-22(24,25)26/h3-6,9-10H,7-8,11-13,27H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ASIC3 assessed as inhibition of peak current by electrophysiology method


Bioorg Med Chem Lett 21: 4255-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.064
BindingDB Entry DOI: 10.7270/Q2DZ08P8
More data for this
Ligand-Target Pair
Amiloride-sensitive cation channel 3


(Homo sapiens)
BDBM50348110
PNG
(CHEMBL1800079)
Show SMILES NCc1sc2cc(ccc2c1Cl)C#Cc1ccc2CCN(Cc3ccccc3)Cc2c1
Show InChI InChI=1S/C27H23ClN2S/c28-27-24-11-9-20(15-25(24)31-26(27)16-29)7-6-19-8-10-22-12-13-30(18-23(22)14-19)17-21-4-2-1-3-5-21/h1-5,8-11,14-15H,12-13,16-18,29H2
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n/an/a 1.71E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ASIC3 assessed as inhibition of peak current by electrophysiology method


Bioorg Med Chem Lett 21: 4255-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.064
BindingDB Entry DOI: 10.7270/Q2DZ08P8
More data for this
Ligand-Target Pair
Amiloride-sensitive cation channel 3


(Homo sapiens)
BDBM50348108
PNG
(CHEMBL1800434)
Show SMILES NCc1sc2cc(ccc2c1Cl)C#Cc1ccc2CCN(CC(F)F)Cc2c1
Show InChI InChI=1S/C22H19ClF2N2S/c23-22-18-6-4-15(10-19(18)28-20(22)11-26)2-1-14-3-5-16-7-8-27(13-21(24)25)12-17(16)9-14/h3-6,9-10,21H,7-8,11-13,26H2
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n/an/a 1.02E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of ASIC3 assessed as inhibition of peak current by electrophysiology method


Bioorg Med Chem Lett 21: 4255-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.064
BindingDB Entry DOI: 10.7270/Q2DZ08P8
More data for this
Ligand-Target Pair