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43 similar compounds to monomer 50192829

Compile data set for download or QSAR
Wt: 686.8
BDBM50218668
Wt: 1098.4
BDBM50218663
Wt: 347.3
BDBM50192841
Wt: 317.3
BDBM50192843
Wt: 377.3
BDBM50192845
Wt: 368.3
BDBM50192846
Wt: 372.8
BDBM50192848
Wt: 331.3
BDBM50192849
Wt: 372.8
BDBM50192850
Wt: 433.4
BDBM50192835
Wt: 482.6
BDBM50192814
Wt: 420.3
BDBM50218661
Wt: 550.6
BDBM50192815
Wt: 512.6
BDBM50192822
Wt: 163.1
BDBM50192839
Displayed 1 to 15 (of 43 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 25 hits for monomerid = 50218668,50218663,50192841,50192843,50192845,50192846,50192848,50192849,50192850,50192835,50192814,50218661,50192815,50192822,50192839   
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
Tryptase


(Homo sapiens (Human))
BDBM50218668
PNG
(CHEMBL42900)
Show SMILES NCCCCCNC(=O)N1CCN(CC1)C(=O)O[C@H]1CCC[C@H](CCC1)OC(=O)N1CCN(CC1)C(=O)NCc1ccc(NC(N)=N)cc1
Show InChI InChI=1S/C33H54N10O6/c34-14-2-1-3-15-37-30(44)40-16-20-42(21-17-40)32(46)48-27-6-4-8-28(9-5-7-27)49-33(47)43-22-18-41(19-23-43)31(45)38-24-25-10-12-26(13-11-25)39-29(35)36/h10-13,27-28H,1-9,14-24,34H2,(H,37,44)(H,38,45)(H4,35,36,39)/t27-,28+
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500n/an/an/an/an/an/an/an/a



Axys Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT3 serotonin receptor in NG 108-15 neuroblastoma glioma cells using [3H]-GR-65,630 radioligand.


Bioorg Med Chem Lett 11: 1629-33 (2001)


Article DOI: 10.1016/s0960-894x(01)00254-2
BindingDB Entry DOI: 10.7270/Q2R78DHK
More data for this
Ligand-Target Pair
Corticotropin releasing factor receptor


(Rattus norvegicus (rat)-RAT)
BDBM50218661
PNG
(CHEMBL98693)
Show SMILES CCCN(CCC)c1nccn2c(nc(C)c12)N(CC)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H27Cl2N5/c1-5-11-26(12-6-2)20-19-15(4)25-21(28(19)13-10-24-20)27(7-3)18-9-8-16(22)14-17(18)23/h8-10,13-14H,5-7,11-12H2,1-4H3
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671n/an/an/an/an/an/an/an/a



DuPont Pharmaceuticals Company

Curated by ChEMBL


Assay Description
Binding affinity at corticotropin releasing hormone receptor in rat frontal cortex homogenates by [125I]Tyr-o-CRF displacement.


Bioorg Med Chem Lett 12: 291-4 (2002)


Article DOI: 10.1016/s0960-894x(01)00741-7
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50192849
PNG
(CHEMBL3358973)
Show SMILES O=c1[nH]cc(nc1-c1ccc2OCOc2c1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H13N3O3/c23-19-18(11-5-6-16-17(7-11)25-10-24-16)22-15(9-21-19)13-8-20-14-4-2-1-3-12(13)14/h1-9,20H,10H2,(H,21,23)
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n/an/a 1.30E+4n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDGFRbeta using poly(Ala,Glu,Lys,Tyr) substrate


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50192843
PNG
(CHEMBL3358968)
Show SMILES COc1ccc(cc1)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H15N3O2/c1-24-13-8-6-12(7-9-13)18-19(23)21-11-17(22-18)15-10-20-16-5-3-2-4-14(15)16/h2-11,20H,1H3,(H,21,23)
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n/an/a 1.90E+4n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDGFRbeta using poly(Ala,Glu,Lys,Tyr) substrate


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM50192846
PNG
(CHEMBL3358992)
Show SMILES COc1cccc(c1)-c1c[nH]c(=O)c(n1)-c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C20H20N2O5/c1-24-14-7-5-6-12(8-14)15-11-21-20(23)18(22-15)13-9-16(25-2)19(27-4)17(10-13)26-3/h5-11H,1-4H3,(H,21,23)
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n/an/a 7.40E+3n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human c-KiT


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50192845
PNG
(CHEMBL3358971)
Show SMILES COc1ccc(c(OC)c1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C21H19N3O4/c1-26-17-9-8-13(19(27-2)20(17)28-3)18-21(25)23-11-16(24-18)14-10-22-15-7-5-4-6-12(14)15/h4-11,22H,1-3H3,(H,23,25)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDGFRbeta using poly(Ala,Glu,Lys,Tyr) substrate


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM50192850
PNG
(CHEMBL3358994)
Show SMILES COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C19H17ClN2O4/c1-24-15-8-12(9-16(25-2)18(15)26-3)17-19(23)21-10-14(22-17)11-5-4-6-13(20)7-11/h4-10H,1-3H3,(H,21,23)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human c-KiT


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50192841
PNG
(CHEMBL3358969)
Show SMILES COc1cc(OC)cc(c1)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C20H17N3O3/c1-25-13-7-12(8-14(9-13)26-2)19-20(24)22-11-18(23-19)16-10-21-17-6-4-3-5-15(16)17/h3-11,21H,1-2H3,(H,22,24)
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n/an/a 4.00E+3n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDGFRbeta using poly(Ala,Glu,Lys,Tyr) substrate


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50192846
PNG
(CHEMBL3358992)
Show SMILES COc1cccc(c1)-c1c[nH]c(=O)c(n1)-c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C20H20N2O5/c1-24-14-7-5-6-12(8-14)15-11-21-20(23)18(22-15)13-9-16(25-2)19(27-4)17(10-13)26-3/h5-11H,1-4H3,(H,21,23)
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n/an/a 2.30E+4n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VEGFR2 using poly(Glu,Tyr) substrate


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50192850
PNG
(CHEMBL3358994)
Show SMILES COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C19H17ClN2O4/c1-24-15-8-12(9-16(25-2)18(15)26-3)17-19(23)21-10-14(22-17)11-5-4-6-13(20)7-11/h4-10H,1-3H3,(H,21,23)
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n/an/a 5.60E+4n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VEGFR2 using poly(Glu,Tyr) substrate


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50192848
PNG
(CHEMBL3358995)
Show SMILES COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccccc1Cl
Show InChI InChI=1S/C19H17ClN2O4/c1-24-15-8-11(9-16(25-2)18(15)26-3)17-19(23)21-10-14(22-17)12-6-4-5-7-13(12)20/h4-10H,1-3H3,(H,21,23)
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n/an/a 5.00E+3n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDGFRbeta using poly(Ala,Glu,Lys,Tyr) substrate


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50192850
PNG
(CHEMBL3358994)
Show SMILES COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1cccc(Cl)c1
Show InChI InChI=1S/C19H17ClN2O4/c1-24-15-8-12(9-16(25-2)18(15)26-3)17-19(23)21-10-14(22-17)11-5-4-6-13(20)7-11/h4-10H,1-3H3,(H,21,23)
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n/an/a 800n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDGFRbeta using poly(Ala,Glu,Lys,Tyr) substrate


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50192846
PNG
(CHEMBL3358992)
Show SMILES COc1cccc(c1)-c1c[nH]c(=O)c(n1)-c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C20H20N2O5/c1-24-14-7-5-6-12(8-14)15-11-21-20(23)18(22-15)13-9-16(25-2)19(27-4)17(10-13)26-3/h5-11H,1-4H3,(H,21,23)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDGFRbeta using poly(Ala,Glu,Lys,Tyr) substrate


J Med Chem 58: 170-82 (2015)


Article DOI: 10.1021/jm500373x
BindingDB Entry DOI: 10.7270/Q2ZG6V0R
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 4


(Homo sapiens (Human))
BDBM50192814
PNG
(CHEMBL3933578)
Show SMILES CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Nc2nc(cs2)-c2sc(C)nc2C)nc1
Show InChI InChI=1S/C23H26N6O2S2/c1-12-21(33-14(3)25-12)19-11-32-23(27-19)28-20-7-4-15(10-24-20)22(31)29-17-5-6-18(29)9-16(8-17)26-13(2)30/h4,7,10-11,16-18H,5-6,8-9H2,1-3H3,(H,26,30)(H,24,27,28)/t16-,17+,18-
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n/an/a 80n/an/an/an/an/an/a



Shionogi& Co., Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV4 assessed as inhibition of 4alpha-PDD-induced activation


Bioorg Med Chem Lett 26: 4936-4941 (2016)


Article DOI: 10.1016/j.bmcl.2016.09.014
BindingDB Entry DOI: 10.7270/Q2154K06
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 4


(Homo sapiens (Human))
BDBM50192815
PNG
(CHEMBL3906180)
Show SMILES Cc1nc(C)c(s1)-c1csc(Nc2ccc(cn2)C(=O)N2[C@H]3CC[C@@H]2C[C@@H](C3)NC(=O)CC(F)(F)F)n1
Show InChI InChI=1S/C24H25F3N6O2S2/c1-12-21(37-13(2)29-12)18-11-36-23(31-18)32-19-6-3-14(10-28-19)22(35)33-16-4-5-17(33)8-15(7-16)30-20(34)9-24(25,26)27/h3,6,10-11,15-17H,4-5,7-9H2,1-2H3,(H,30,34)(H,28,31,32)/t15-,16+,17-
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n/an/a 19n/an/an/an/an/an/a



Shionogi& Co., Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV4 assessed as inhibition of 4alpha-PDD-induced activation


Bioorg Med Chem Lett 26: 4936-4941 (2016)


Article DOI: 10.1016/j.bmcl.2016.09.014
BindingDB Entry DOI: 10.7270/Q2154K06
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus)
BDBM50192822
PNG
(CHEMBL3897222)
Show SMILES Cc1nc(C)c(s1)-c1csc(Nc2ccc(cn2)C(=O)N2[C@H]3CC[C@@H]2C\C(C3)=N/OCCCO)n1
Show InChI InChI=1S/C24H28N6O3S2/c1-14-22(35-15(2)26-14)20-13-34-24(27-20)28-21-7-4-16(12-25-21)23(32)30-18-5-6-19(30)11-17(10-18)29-33-9-3-8-31/h4,7,12-13,18-19,31H,3,5-6,8-11H2,1-2H3,(H,25,27,28)/b29-17-/t18-,19+/m0/s1
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n/an/a 57n/an/an/an/an/an/a



Shionogi& Co., Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at rat TRPV4 assessed as inhibition of 4alpha-PDD-induced activation


Bioorg Med Chem Lett 26: 4936-4941 (2016)


Article DOI: 10.1016/j.bmcl.2016.09.014
BindingDB Entry DOI: 10.7270/Q2154K06
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 4


(Homo sapiens (Human))
BDBM50192822
PNG
(CHEMBL3897222)
Show SMILES Cc1nc(C)c(s1)-c1csc(Nc2ccc(cn2)C(=O)N2[C@H]3CC[C@@H]2C\C(C3)=N/OCCCO)n1
Show InChI InChI=1S/C24H28N6O3S2/c1-14-22(35-15(2)26-14)20-13-34-24(27-20)28-21-7-4-16(12-25-21)23(32)30-18-5-6-19(30)11-17(10-18)29-33-9-3-8-31/h4,7,12-13,18-19,31H,3,5-6,8-11H2,1-2H3,(H,25,27,28)/b29-17-/t18-,19+/m0/s1
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n/an/a 2.90n/an/an/an/an/an/a



Shionogi& Co., Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV4 assessed as inhibition of 4alpha-PDD-induced activation


Bioorg Med Chem Lett 26: 4936-4941 (2016)


Article DOI: 10.1016/j.bmcl.2016.09.014
BindingDB Entry DOI: 10.7270/Q2154K06
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50192835
PNG
(CHEMBL3981654 | US10188627, Compound 8x)
Show SMILES CN(Cc1ccccc1OCCC[C@@H]1C[C@@H]1C(O)=O)C(=O)c1ccc(cc1)-c1ccco1
Show InChI InChI=1S/C26H27NO5/c1-27(25(28)19-12-10-18(11-13-19)23-9-5-15-31-23)17-21-6-2-3-8-24(21)32-14-4-7-20-16-22(20)26(29)30/h2-3,5-6,8-13,15,20,22H,4,7,14,16-17H2,1H3,(H,29,30)/t20-,22+/m1/s1
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n/an/an/an/a 265n/an/an/an/a



Temple University

Curated by ChEMBL


Assay Description
Transactivation of ProLink tagged human PPARdelta transfected in CHO-K1 cells assessed as interaction with EA labelled SRCP after 3 to 16 hrs by beta...


ACS Med Chem Lett 7: 824-5 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00301
BindingDB Entry DOI: 10.7270/Q2WH2RZ8
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50192835
PNG
(CHEMBL3981654 | US10188627, Compound 8x)
Show SMILES CN(Cc1ccccc1OCCC[C@@H]1C[C@@H]1C(O)=O)C(=O)c1ccc(cc1)-c1ccco1
Show InChI InChI=1S/C26H27NO5/c1-27(25(28)19-12-10-18(11-13-19)23-9-5-15-31-23)17-21-6-2-3-8-24(21)32-14-4-7-20-16-22(20)26(29)30/h2-3,5-6,8-13,15,20,22H,4,7,14,16-17H2,1H3,(H,29,30)/t20-,22+/m1/s1
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n/an/an/an/a 83n/an/an/an/a



Temple University

Curated by ChEMBL


Assay Description
Transactivation of human Gal4-PPARdelta LBD transfected in African green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


ACS Med Chem Lett 7: 824-5 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00301
BindingDB Entry DOI: 10.7270/Q2WH2RZ8
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50192839
PNG
(CHEMBL3984982)
Show SMILES C[C@H]1Nc2cccnc2NC1=O
Show InChI InChI=1S/C8H9N3O/c1-5-8(12)11-7-6(10-5)3-2-4-9-7/h2-5,10H,1H3,(H,9,11,12)/t5-/m1/s1
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n/an/an/a 6.00E+5n/an/an/an/an/a



Institute of Harvard and MIT

Curated by ChEMBL


Assay Description
Binding affinity to GSK-3 beta (unknown origin) after 30 mins by isothermal titration calorimetry


ACS Med Chem Lett 7: 852-6 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00230
BindingDB Entry DOI: 10.7270/Q2RR217B
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50192835
PNG
(CHEMBL3981654 | US10188627, Compound 8x)
Show SMILES CN(Cc1ccccc1OCCC[C@@H]1C[C@@H]1C(O)=O)C(=O)c1ccc(cc1)-c1ccco1
Show InChI InChI=1S/C26H27NO5/c1-27(25(28)19-12-10-18(11-13-19)23-9-5-15-31-23)17-21-6-2-3-8-24(21)32-14-4-7-20-16-22(20)26(29)30/h2-3,5-6,8-13,15,20,22H,4,7,14,16-17H2,1H3,(H,29,30)/t20-,22+/m1/s1
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n/an/an/an/a 265n/an/an/an/a



Mitobridge, Inc.; Salk Institute for Biological Studies

US Patent


Assay Description
Medium including test compound was aspirated and washed with PBS. 50 μl PBS including 1 mM Mg++ and Ca++ were then added to each well. The lucif...


US Patent US10188627 (2019)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50192835
PNG
(CHEMBL3981654 | US10188627, Compound 8x)
Show SMILES CN(Cc1ccccc1OCCC[C@@H]1C[C@@H]1C(O)=O)C(=O)c1ccc(cc1)-c1ccco1
Show InChI InChI=1S/C26H27NO5/c1-27(25(28)19-12-10-18(11-13-19)23-9-5-15-31-23)17-21-6-2-3-8-24(21)32-14-4-7-20-16-22(20)26(29)30/h2-3,5-6,8-13,15,20,22H,4,7,14,16-17H2,1H3,(H,29,30)/t20-,22+/m1/s1
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n/an/an/an/a 82.5n/an/an/an/a



Mitobridge, Inc.; Salk Institute for Biological Studies

US Patent


Assay Description
Cell Handling: PathHunter NHR cell lines were expanded from freezer stocks according to standard procedures. Cells were seeded in a total volume of 2...


US Patent US10188627 (2019)

More data for this
Ligand-Target Pair
PPAR delta protein


(Rattus norvegicus (Rat))
BDBM50192835
PNG
(CHEMBL3981654 | US10188627, Compound 8x)
Show SMILES CN(Cc1ccccc1OCCC[C@@H]1C[C@@H]1C(O)=O)C(=O)c1ccc(cc1)-c1ccco1
Show InChI InChI=1S/C26H27NO5/c1-27(25(28)19-12-10-18(11-13-19)23-9-5-15-31-23)17-21-6-2-3-8-24(21)32-14-4-7-20-16-22(20)26(29)30/h2-3,5-6,8-13,15,20,22H,4,7,14,16-17H2,1H3,(H,29,30)/t20-,22+/m1/s1
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n/an/an/an/a 265n/an/an/an/a



Mitobridge, Inc.; Salk Institute for Biological Studies

US Patent


Assay Description
Medium including test compound was aspirated and washed with PBS. 50 μl PBS including 1 mM Mg++ and Ca++ were then added to each well. The lucif...


US Patent US10188627 (2019)

More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))
BDBM50218663
PNG
(CHEMBL442480)
Show SMILES CC[C@H]1C[C@H](C)[C@@]2(NC1=O)O[C@@H](C[C@H](O)[C@@H](C)CCCCCC(C)[C@@H]1CCCCC[C@H](O)[C@H](C)[C@@H](O)[C@@H](CCC(C)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc3cccc(O)c3)C(=O)N3CCC[C@H](N3)C(=O)O1)[C@H](C)[C@H](O)[C@@H]2C
Show InChI InChI=1S/C60H99N5O13/c1-11-43-30-37(6)60(63-55(43)72)41(10)53(70)40(9)51(78-60)33-49(69)35(4)20-14-12-15-21-36(5)50-26-17-13-16-25-48(68)39(8)54(71)45(28-27-38(7)66)56(73)62-52(34(2)3)57(74)61-47(32-42-22-18-23-44(67)31-42)58(75)65-29-19-24-46(64-65)59(76)77-50/h18,22-23,31,34-37,39-41,43,45-54,64,67-71H,11-17,19-21,24-30,32-33H2,1-10H3,(H,61,74)(H,62,73)(H,63,72)/t35-,36?,37-,39-,40-,41-,43-,45+,46-,47-,48-,49-,50-,51-,52-,53-,54+,60+/m0/s1
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n/an/a 0.400n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT3 serotonin receptor in NG 108-15 neuroblastoma glioma cells using [3H]-GR-65,630 radioligand.


Bioorg Med Chem Lett 11: 1609-12 (2001)


Article DOI: 10.1016/s0960-894x(01)00293-1
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))
BDBM50218663
PNG
(CHEMBL442480)
Show SMILES CC[C@H]1C[C@H](C)[C@@]2(NC1=O)O[C@@H](C[C@H](O)[C@@H](C)CCCCCC(C)[C@@H]1CCCCC[C@H](O)[C@H](C)[C@@H](O)[C@@H](CCC(C)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc3cccc(O)c3)C(=O)N3CCC[C@H](N3)C(=O)O1)[C@H](C)[C@H](O)[C@@H]2C
Show InChI InChI=1S/C60H99N5O13/c1-11-43-30-37(6)60(63-55(43)72)41(10)53(70)40(9)51(78-60)33-49(69)35(4)20-14-12-15-21-36(5)50-26-17-13-16-25-48(68)39(8)54(71)45(28-27-38(7)66)56(73)62-52(34(2)3)57(74)61-47(32-42-22-18-23-44(67)31-42)58(75)65-29-19-24-46(64-65)59(76)77-50/h18,22-23,31,34-37,39-41,43,45-54,64,67-71H,11-17,19-21,24-30,32-33H2,1-10H3,(H,61,74)(H,62,73)(H,63,72)/t35-,36?,37-,39-,40-,41-,43-,45+,46-,47-,48-,49-,50-,51-,52-,53-,54+,60+/m0/s1
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n/an/a 26n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Binding affinity to 5-HT3 serotonin receptor in NG108-15 neuroblastoma glioma cells using [3H]-GR-65,630 radioligand


Bioorg Med Chem Lett 11: 1609-12 (2001)


Article DOI: 10.1016/s0960-894x(01)00293-1
More data for this
Ligand-Target Pair