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Patent code US10252984

Compile Data Set for Download or QSAR
Found 51 hits of Enzyme Inhibition Constant Data   
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
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375076
PNG
(US10252984, Table 2.37)
Show SMILES COC(=O)c1c(N)n(CC=C)c2nc3ccccc3nc12
Show InChI InChI=1S/C15H14N4O2/c1-3-8-19-13(16)11(15(20)21-2)12-14(19)18-10-7-5-4-6-9(10)17-12/h3-7H,1,8,16H2,2H3
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n/an/a 973n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375078
PNG
(US10252984, Table 2.39)
Show SMILES CCCCCn1c(N)c(C(=O)OC)c2nc3ccccc3nc12
Show InChI InChI=1S/C17H20N4O2/c1-3-4-7-10-21-15(18)13(17(22)23-2)14-16(21)20-12-9-6-5-8-11(12)19-14/h5-6,8-9H,3-4,7,10,18H2,1-2H3
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n/an/a 1.03E+3n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375071
PNG
(US10252984, Table 2.32)
Show SMILES CN(C)[C@H]1C2CC3Cc4c(ccc(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O)N(C)C
Show InChI InChI=1/C23H27N3O7/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28/h5-6,9,11,17,27,29-30,33H,7-8H2,1-4H3,(H2,24,32)/t9?,11?,17-,23-/s2
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n/an/a 1.37E+3n/an/an/an/an/an/a



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US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375079
PNG
(US10252984, Table 2.40)
Show SMILES CCCCCCn1c(N)c(C(=O)OC)c2nc3ccccc3nc12
Show InChI InChI=1S/C18H22N4O2/c1-3-4-5-8-11-22-16(19)14(18(23)24-2)15-17(22)21-13-10-7-6-9-12(13)20-15/h6-7,9-10H,3-5,8,11,19H2,1-2H3
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n/an/a 1.43E+3n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375084
PNG
(US10252984, Table 2.45)
Show SMILES Cc1cccc(c1)-c1nnc(SCC(O)=O)[nH]1
Show InChI InChI=1S/C11H11N3O2S/c1-7-3-2-4-8(5-7)10-12-11(14-13-10)17-6-9(15)16/h2-5H,6H2,1H3,(H,15,16)(H,12,13,14)
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n/an/a 1.44E+3n/an/an/an/an/an/a



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US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375077
PNG
(US10252984, Table 2.38)
Show SMILES CCCCn1c(N)c(C#N)c2nc3ccccc3nc12
Show InChI InChI=1S/C15H15N5/c1-2-3-8-20-14(17)10(9-16)13-15(20)19-12-7-5-4-6-11(12)18-13/h4-7H,2-3,8,17H2,1H3
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n/an/a 1.56E+3n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

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TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375063
PNG
(US10252984, Table 2.24)
Show SMILES CCOc1cccc(=O)c2c(C)[nH]c(C)c12
Show InChI InChI=1S/C13H15NO2/c1-4-16-11-7-5-6-10(15)12-8(2)14-9(3)13(11)12/h5-7,14H,4H2,1-3H3
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n/an/a 2.55E+3n/an/an/an/an/an/a



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US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375069
PNG
(US10252984, Table 2.30)
Show SMILES CCOC(=O)c1c(N)n(C2CC2)c2nc3ccccc3nc12
Show InChI InChI=1S/C16H16N4O2/c1-2-22-16(21)12-13-15(20(14(12)17)9-7-8-9)19-11-6-4-3-5-10(11)18-13/h3-6,9H,2,7-8,17H2,1H3
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n/an/a 2.83E+3n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375074
PNG
(US10252984, Table 2.35)
Show SMILES CCOc1cccc(=O)c2c(C)n(c(C)c12)-c1ccc(C)cc1
Show InChI InChI=1S/C20H21NO2/c1-5-23-18-8-6-7-17(22)19-14(3)21(15(4)20(18)19)16-11-9-13(2)10-12-16/h6-12H,5H2,1-4H3
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n/an/a 3.40E+3n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375056
PNG
(US10252984, Table 2.17)
Show SMILES CCOc1cc(cc(=O)c2c(C)oc(C)c12)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C19H18O5/c1-4-23-17-9-13(12-5-6-14(20)15(21)7-12)8-16(22)18-10(2)24-11(3)19(17)18/h5-9,20-21H,4H2,1-3H3
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n/an/a 4.41E+3n/an/an/an/an/an/a



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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375049
PNG
(US10252984, Table 2.10)
Show SMILES CCOc1ccc(NC(c2ccccn2)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1/C23H21N3O2/c1-2-28-18-11-9-17(10-12-18)26-22(20-7-3-4-14-24-20)19-13-8-16-6-5-15-25-21(16)23(19)27/h3-15,22,26-27H,2H2,1H3
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n/an/a 4.48E+3n/an/an/an/an/an/a



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TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375086
PNG
(US10252984, Table 2.47)
Show SMILES OC(=O)CSc1nnc([nH]1)-c1cccs1
Show InChI InChI=1S/C8H7N3O2S2/c12-6(13)4-15-8-9-7(10-11-8)5-2-1-3-14-5/h1-3H,4H2,(H,12,13)(H,9,10,11)
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n/an/a 4.60E+3n/an/an/an/an/an/a



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TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375085
PNG
(US10252984, Table 2.46)
Show SMILES OC(=O)CSc1nnc([nH]1)-c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C11H8F3N3O3S/c12-11(13,14)20-7-3-1-6(2-4-7)9-15-10(17-16-9)21-5-8(18)19/h1-4H,5H2,(H,18,19)(H,15,16,17)
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n/an/a 5.92E+3n/an/an/an/an/an/a



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US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375045
PNG
(US10252984, Table 2.6)
Show SMILES Cc1cc(NC(c2ccccn2)c2ccc3cccnc3c2O)no1
Show InChI InChI=1/C19H16N4O2/c1-12-11-16(23-25-12)22-18(15-6-2-3-9-20-15)14-8-7-13-5-4-10-21-17(13)19(14)24/h2-11,18,24H,1H3,(H,22,23)
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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375052
PNG
(US10252984, Table 2.13)
Show SMILES NC1=C(C#N)C(c2ccc(N)cc2O1)c1cc2cc3OCOc3cc2nc1Cl
Show InChI InChI=1/C20H13ClN4O3/c21-19-12(3-9-4-16-17(27-8-26-16)6-14(9)25-19)18-11-2-1-10(23)5-15(11)28-20(24)13(18)7-22/h1-6,18H,8,23-24H2
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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM23411
PNG
(5,6,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-...)
Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)c(O)c(O)cc2o1
Show InChI InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)11-5-9(17)13-12(21-11)6-10(18)14(19)15(13)20/h1-6,16,18-20H
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n/an/a 6.61E+3n/an/an/an/an/an/a



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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375081
PNG
(US10252984, Table 2.42)
Show SMILES [O-][N+](=O)c1cc(ccc1Cl)C1=NN=C(NCc2ccco2)SC1
Show InChI InChI=1S/C14H11ClN4O3S/c15-11-4-3-9(6-13(11)19(20)21)12-8-23-14(18-17-12)16-7-10-2-1-5-22-10/h1-6H,7-8H2,(H,16,18)
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n/an/a 6.62E+3n/an/an/an/an/an/a



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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375080
PNG
(US10252984, Table 2.41)
Show SMILES OC(=O)c1ccc(cc1)[C@@H]1Nc2ccc(I)cc2[C@@H]2C=CC[C@H]12
Show InChI InChI=1/C19H16INO2/c20-13-8-9-17-16(10-13)14-2-1-3-15(14)18(21-17)11-4-6-12(7-5-11)19(22)23/h1-2,4-10,14-15,18,21H,3H2,(H,22,23)/t14-,15+,18+/s2
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n/an/a 6.66E+3n/an/an/an/an/an/a



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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375048
PNG
(US10252984, Table 2.9)
Show SMILES Oc1c(ccc2cccnc12)C(Nc1ccccn1)c1cccnc1
Show InChI InChI=1/C20H16N4O/c25-20-16(9-8-14-5-4-12-23-19(14)20)18(15-6-3-10-21-13-15)24-17-7-1-2-11-22-17/h1-13,18,25H,(H,22,24)
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n/an/a 6.75E+3n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM34883
PNG
(5-[2-keto-2-(2,3,4-trihydroxyphenyl)ethyl]furan-2-...)
Show SMILES CCOC(=O)c1ccc(CC(=O)c2ccc(O)c(O)c2O)o1
Show InChI InChI=1S/C15H14O7/c1-2-21-15(20)12-6-3-8(22-12)7-11(17)9-4-5-10(16)14(19)13(9)18/h3-6,16,18-19H,2,7H2,1H3
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n/an/a 7.05E+3n/an/an/an/an/an/a



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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375046
PNG
(US10252984, Table 2.7)
Show SMILES Cc1cccc(NC2=NC(=O)\C(S2)=C\c2ccc(O)c(O)c2)c1C
Show InChI InChI=1S/C18H16N2O3S/c1-10-4-3-5-13(11(10)2)19-18-20-17(23)16(24-18)9-12-6-7-14(21)15(22)8-12/h3-9,21-22H,1-2H3,(H,19,20,23)/b16-9-
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n/an/a 7.11E+3n/an/an/an/an/an/a



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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375075
PNG
(US10252984, Table 2.36)
Show SMILES COc1ccc(cc1)-c1cc(=O)oc2c(O)c(O)ccc12
Show InChI InChI=1S/C16H12O5/c1-20-10-4-2-9(3-5-10)12-8-14(18)21-16-11(12)6-7-13(17)15(16)19/h2-8,17,19H,1H3
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n/an/a 7.16E+3n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

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Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375044
PNG
(US10252984, Table 2.5)
Show SMILES CCN(CC)c1ccc(C2Nc3cccc4cccc(N2)c34)c(O)c1
Show InChI InChI=1S/C21H23N3O/c1-3-24(4-2)15-11-12-16(19(25)13-15)21-22-17-9-5-7-14-8-6-10-18(23-21)20(14)17/h5-13,21-23,25H,3-4H2,1-2H3
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n/an/a 8.44E+3n/an/an/an/an/an/a



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US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM50009001
PNG
(5,6,7-Trihydroxyflavone | 5,6,7-trihydroxy-2-pheny...)
Show SMILES Oc1cc2oc(cc(=O)c2c(O)c1O)-c1ccccc1
Show InChI InChI=1S/C15H10O5/c16-9-6-11(8-4-2-1-3-5-8)20-12-7-10(17)14(18)15(19)13(9)12/h1-7,17-19H
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n/an/a 8.70E+3n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375068
PNG
(US10252984, Table 2.29)
Show SMILES CCN(CC)c1ccc(cc1)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O
Show InChI InChI=1S/C19H25N5O2/c1-5-24(6-2)14-9-7-13(8-10-14)17(15-11(3)20-22-18(15)25)16-12(4)21-23-19(16)26/h7-10,17H,5-6H2,1-4H3,(H2,20,22,25)(H2,21,23,26)
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n/an/a 9.93E+3n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375064
PNG
(US10252984, Table 2.25)
Show SMILES CC(C)c1c(O)c(O)c(\C=N\CCCN2CCOCC2)c2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(\C=N\CCCN3CCOCC3)c2c1O
Show InChI InChI=1S/C44H58N4O8/c1-25(2)33-29-21-27(5)35(41(51)37(29)31(39(49)43(33)53)23-45-9-7-11-47-13-17-55-18-14-47)36-28(6)22-30-34(26(3)4)44(54)40(50)32(38(30)42(36)52)24-46-10-8-12-48-15-19-56-20-16-48/h21-26,49-54H,7-20H2,1-6H3/b45-23+,46-24+
PDB
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UniChem
US Patent
n/an/a 1.01E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375047
PNG
(US10252984, Table 2.8)
Show SMILES COc1ccc(NC(c2ccccn2)c2ccc3cccnc3c2O)cc1
Show InChI InChI=1/C22H19N3O2/c1-27-17-10-8-16(9-11-17)25-21(19-6-2-3-13-23-19)18-12-7-15-5-4-14-24-20(15)22(18)26/h2-14,21,25-26H,1H3
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US Patent
n/an/a 1.03E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375082
PNG
(US10252984, Table 2.43)
Show SMILES C(NC1=NN=C(CS1)c1ccc(cc1)-c1ccccc1)c1ccco1
Show InChI InChI=1S/C20H17N3OS/c1-2-5-15(6-3-1)16-8-10-17(11-9-16)19-14-25-20(23-22-19)21-13-18-7-4-12-24-18/h1-12H,13-14H2,(H,21,23)
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US Patent
n/an/a 1.04E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375057
PNG
(US10252984, Table 2.18)
Show SMILES NC1=C(C#N)C(c2cccs2)c2ccc(N)cc2O1
Show InChI InChI=1/C14H11N3OS/c15-7-10-13(12-2-1-5-19-12)9-4-3-8(16)6-11(9)18-14(10)17/h1-6,13H,16-17H2
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US Patent
n/an/a 1.18E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375073
PNG
(US10252984, Table 2.34)
Show SMILES Cc1ccc(c(NC2OC(CO)C(O)C2O)c1)[N+]([O-])=O
Show InChI InChI=1/C12H16N2O6/c1-6-2-3-8(14(18)19)7(4-6)13-12-11(17)10(16)9(5-15)20-12/h2-4,9-13,15-17H,5H2,1H3
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n/an/a 1.20E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375089
PNG
(US10252984, Table 2.50)
Show SMILES c1cc2cccc3[nH]cnc(c1)c23
Show InChI InChI=1S/C11H8N2/c1-3-8-4-2-6-10-11(8)9(5-1)12-7-13-10/h1-7H,(H,12,13)
PDB
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UniChem
US Patent
n/an/a 1.25E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375058
PNG
(US10252984, Table 2.19)
Show SMILES NC(=O)c1cc(N)c2C(=O)c3ccccc3C(=O)c2c1N
Show InChI InChI=1S/C15H11N3O3/c16-9-5-8(15(18)21)12(17)11-10(9)13(19)6-3-1-2-4-7(6)14(11)20/h1-5H,16-17H2,(H2,18,21)
PDB
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US Patent
n/an/a 1.27E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375066
PNG
(US10252984, Table 2.27)
Show SMILES CC(C)C1=C(O)C(=O)\C(=C/NCCCN2CCOCC2)c2c(O)c(c(C)cc12)-c1c(C)cc2C(C(C)C)=C(O)C(=O)\C(=C/NCCCN3CCOCC3)c2c1O
Show InChI InChI=1S/C44H58N4O8/c1-25(2)33-29-21-27(5)35(41(51)37(29)31(39(49)43(33)53)23-45-9-7-11-47-13-17-55-18-14-47)36-28(6)22-30-34(26(3)4)44(54)40(50)32(38(30)42(36)52)24-46-10-8-12-48-15-19-56-20-16-48/h21-26,45-46,51-54H,7-20H2,1-6H3/b31-23-,32-24-
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n/an/a 1.69E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375088
PNG
(US10252984, Table 2.49)
Show SMILES Nc1ccc(CCc2nc3cc(N)ccc3o2)cc1
Show InChI InChI=1S/C15H15N3O/c16-11-4-1-10(2-5-11)3-8-15-18-13-9-12(17)6-7-14(13)19-15/h1-2,4-7,9H,3,8,16-17H2
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n/an/a 1.78E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM89185
PNG
(3-Amino-5-(2-diethylamino-ethyl)-5H-pyrido[4,3-b]i...)
Show SMILES CCN(CC)CCn1c2ccccc2c2cnc(N)c(C#N)c12
Show InChI InChI=1S/C18H21N5/c1-3-22(4-2)9-10-23-16-8-6-5-7-13(16)15-12-21-18(20)14(11-19)17(15)23/h5-8,12H,3-4,9-10H2,1-2H3,(H2,20,21)
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US Patent
n/an/a 1.88E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375060
PNG
(US10252984, Table 2.21)
Show SMILES Cc1ccc(cc1)C1C(C#N)=C(N)Oc2cc(N)ccc12
Show InChI InChI=1/C17H15N3O/c1-10-2-4-11(5-3-10)16-13-7-6-12(19)8-15(13)21-17(20)14(16)9-18/h2-8,16H,19-20H2,1H3
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US Patent
n/an/a 2.60E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375043
PNG
(US10252984, Table 2.4)
Show SMILES Oc1ccc(cc1O)-c1nc2ccc3ccccc3c2c2CCCc12
Show InChI InChI=1S/C22H17NO2/c24-19-11-9-14(12-20(19)25)22-17-7-3-6-16(17)21-15-5-2-1-4-13(15)8-10-18(21)23-22/h1-2,4-5,8-12,24-25H,3,6-7H2
PDB
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n/an/a 2.84E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375042
PNG
(US10252984, Table 2.3)
Show SMILES COc1cc(\C=C2\SC(=S)N(C2=O)c2cccnc2)ccc1O
Show InChI InChI=1S/C16H12N2O3S2/c1-21-13-7-10(4-5-12(13)19)8-14-15(20)18(16(22)23-14)11-3-2-6-17-9-11/h2-9,19H,1H3/b14-8+
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n/an/a 4.06E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375065
PNG
(US10252984, Table 2.26)
Show SMILES Nc1ccc2c3c1C(=O)OC3(O)c1ccccc1C2=O
Show InChI InChI=1/C15H9NO4/c16-10-6-5-8-12-11(10)14(18)20-15(12,19)9-4-2-1-3-7(9)13(8)17/h1-6,19H,16H2
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n/an/a 4.70E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375051
PNG
(US10252984, Table 2.12)
Show SMILES CCn1c(COc2ccccc2)nnc1SCCC(O)=O
Show InChI InChI=1S/C14H17N3O3S/c1-2-17-12(10-20-11-6-4-3-5-7-11)15-16-14(17)21-9-8-13(18)19/h3-7H,2,8-10H2,1H3,(H,18,19)
PDB
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375054
PNG
(US10252984, Table 2.15)
Show SMILES O=S(=O)(Nc1ccc(cc1)-n1cnnn1)c1ccc(cc1)S(=O)(=O)N1CCCCCC1
Show InChI InChI=1S/C19H22N6O4S2/c26-30(27,21-16-5-7-17(8-6-16)25-15-20-22-23-25)18-9-11-19(12-10-18)31(28,29)24-13-3-1-2-4-14-24/h5-12,15,21H,1-4,13-14H2
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375083
PNG
(US10252984, Table 2.44)
Show SMILES Oc1ccc(cc1)-c1nnc(NCCc2ccccc2)s1
Show InChI InChI=1S/C16H15N3OS/c20-14-8-6-13(7-9-14)15-18-19-16(21-15)17-11-10-12-4-2-1-3-5-12/h1-9,20H,10-11H2,(H,17,19)
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375070
PNG
(US10252984, Table 2.31)
Show SMILES CCCCC(CC)CNC(=O)c1ccc(N\N=C2/C(=O)Nc3ccc(Br)cc23)cc1
Show InChI InChI=1/C23H27BrN4O2/c1-3-5-6-15(4-2)14-25-22(29)16-7-10-18(11-8-16)27-28-21-19-13-17(24)9-12-20(19)26-23(21)30/h7-13,15,27H,3-6,14H2,1-2H3,(H,25,29)(H,26,28,30)
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375090
PNG
(US10252984, Table 2.51)
Show SMILES COc1ccc(cc1)-c1cnc(o1)-c1cccnc1
Show InChI InChI=1S/C15H12N2O2/c1-18-13-6-4-11(5-7-13)14-10-17-15(19-14)12-3-2-8-16-9-12/h2-10H,1H3
PDB
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375055
PNG
(US10252984, Table 2.16)
Show SMILES CCNC(=S)N(CCO)Cc1cc2cc3OCOc3cc2[nH]c1=O
Show InChI InChI=1S/C16H19N3O4S/c1-2-17-16(24)19(3-4-20)8-11-5-10-6-13-14(23-9-22-13)7-12(10)18-15(11)21/h5-7,20H,2-4,8-9H2,1H3,(H,17,24)(H,18,21)
PDB
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375059
PNG
(US10252984, Table 2.20)
Show SMILES O=C1Nc2ccc(c3cccc1c23)S(=O)(=O)N1CCCCC1
Show InChI InChI=1S/C16H16N2O3S/c19-16-12-6-4-5-11-14(8-7-13(17-16)15(11)12)22(20,21)18-9-2-1-3-10-18/h4-8H,1-3,9-10H2,(H,17,19)
PDB
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375061
PNG
(US10252984, Table 2.22)
Show SMILES CC(=O)Nc1ccc(Nc2nnc(-c3ccc(O)cc3)c3ccccc23)cc1
Show InChI InChI=1S/C22H18N4O2/c1-14(27)23-16-8-10-17(11-9-16)24-22-20-5-3-2-4-19(20)21(25-26-22)15-6-12-18(28)13-7-15/h2-13,28H,1H3,(H,23,27)(H,24,26)
PDB
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375050
PNG
(US10252984, Table 2.11)
Show SMILES Cc1nc2ccccn2c1-c1csc(Nc2ccc(N)cc2)n1
Show InChI InChI=1S/C17H15N5S/c1-11-16(22-9-3-2-4-15(22)19-11)14-10-23-17(21-14)20-13-7-5-12(18)6-8-13/h2-10H,18H2,1H3,(H,20,21)
PDB
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375062
PNG
(US10252984, Table 2.23)
Show SMILES COCCNC(=O)CN(C(=O)c1snc(C(N)=O)c1N)c1ccccc1
Show InChI InChI=1S/C16H19N5O4S/c1-25-8-7-19-11(22)9-21(10-5-3-2-4-6-10)16(24)14-12(17)13(15(18)23)20-26-14/h2-6H,7-9,17H2,1H3,(H2,18,23)(H,19,22)
PDB
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375053
PNG
(US10252984, Table 2.14)
Show SMILES Cc1ccc(o1)-c1ccccc1NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N1CCCCCC1
Show InChI InChI=1S/C23H26N2O5S2/c1-18-10-15-23(30-18)21-8-4-5-9-22(21)24-31(26,27)19-11-13-20(14-12-19)32(28,29)25-16-6-2-3-7-17-25/h4-5,8-15,24H,2-3,6-7,16-17H2,1H3
PDB
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n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
G protein-coupled receptor kinase 6


(Homo sapiens (Human))
BDBM375087
PNG
(US10252984, Table 2.48)
Show SMILES Cc1ccc2nc(NC=O)sc2c1
Show InChI InChI=1S/C9H8N2OS/c1-6-2-3-7-8(4-6)13-9(11-7)10-5-12/h2-5H,1H3,(H,10,11,12)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
KEGG
PC cid
PC sid
UniChem
US Patent
n/an/a>6.00E+4n/an/an/an/an/an/a



Mayo Foundation for Medical Education and Research

US Patent


Assay Description
TBD


US Patent US10252984 (2019)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%